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Imidazo[1,5-a][1,4]benzodiazepines

Description:

Compounds containing an imidazole ring and a 1,4-benzodiazepine ring system, both sharing one nitrogen atom.

Ancestors:

Organic compounds ⮕ Organoheterocyclic compounds ⮕ Benzodiazepines ⮕ 1,4-benzodiazepines ⮕ Imidazo[1,5-a][1,4]benzodiazepines

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  1. HZ-166
    HZ-166
    CAS: 612527-56-7 PubChem CID: 10309028
    Out of Stock Item #: H978244
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    Technical Identifiers
    IUPAC Name
    ethyl 8-ethynyl-6-pyridin-2-yl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate
    SMILES
    CCOC(=O)C1=C2CN=C(C3=C(N2C=N1)C=CC(=C3)C#C)C4=CC=CC=N4
    InChIKey
    ZSEDMNMFODMQRD-UHFFFAOYSA-N
    InChI
    1S/C21H16N4O2/c1-3-14-8-9-17-15(11-14)19(16-7-5-6-10-22-16)23-12-18-20(21(26)27-4-2)24-13-25(17)18/h1,5-11,13H,4,12H2,2H3
  2. Bretazenil
    Bretazenil
    CAS: 84379-13-5 PubChem CID: 107926 Formula: C19H20BrN3O3 Molecular Weight: 418.28
    Solid ≥97%
    Out of Stock Item #: B769186
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    Technical Identifiers
    IUPAC Name
    tert-butyl (7S)-14-bromo-12-oxo-2,4,11-triazatetracyclo[11.4.0.02,6.07,11]heptadeca-1(17),3,5,13,15-pentaene-5-carboxylate
    SMILES
    CC(C)(C)OC(=O)C1=C2C3CCCN3C(=O)C4=C(N2C=N1)C=CC=C4Br
    InChIKey
    LWUDDYHYYNNIQI-ZDUSSCGKSA-N
    InChI
    1S/C19H20BrN3O3/c1-19(2,3)26-18(25)15-16-13-8-5-9-22(13)17(24)14-11(20)6-4-7-12(14)23(16)10-21-15/h4,6-7,10,13H,5,8-9H2,1-3H3/t13-/m0/s1
  3. Ethyl 8-chloro-5,6-dihydro-5-methyl-6-oxo-4H-imidazo(1,5-a)(1,4)benzodiazepine-3-carboxylate
    Ethyl 8-chloro-5,6-dihydro-5-methyl-6-oxo-4H-imidazo(1,5-a)(1,4)benzodiazepine-3-carboxylate
    CAS: 78756-33-9 PubChem CID: 114888 Formula: C15H14ClN3O3 Molecular Weight: 319.74
    Out of Stock Item #: E668022
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    IUPAC Name
    ethyl 8-chloro-5-methyl-6-oxo-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate
    SMILES
    CCOC(=O)C1=C2CN(C(=O)C3=C(N2C=N1)C=CC(=C3)Cl)C
    InChIKey
    QORLMYYHZLDYOR-UHFFFAOYSA-N
    InChI
    1S/C15H14ClN3O3/c1-3-22-15(21)13-12-7-18(2)14(20)10-6-9(16)4-5-11(10)19(12)8-17-13/h4-6,8H,3,7H2,1-2H3
    Synonyms
    Ethyl 8-chloro-5,6-dihydro-5-methyl-6-oxo-4H-imidazo(1,5-a)(1,4)benzodiazepine-3-carboxylate | ZRD5QFZ6DV | Ro-151310...
  4. Flumazenil acid
    Flumazenil acid
    CAS: 84378-44-9 PubChem CID: 134757 Formula: C13H10FN3O3 Molecular Weight: 275.24
    Solid Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥99%
    Out of Stock Item #: F648923
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    IUPAC Name
    8-fluoro-5-methyl-6-oxo-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid
    SMILES
    CN1CC2=C(N=CN2C3=C(C1=O)C=C(C=C3)F)C(=O)O
    InChIKey
    SFVXVWJBSJCRJO-UHFFFAOYSA-N
    InChI
    1S/C13H10FN3O3/c1-16-5-10-11(13(19)20)15-6-17(10)9-3-2-7(14)4-8(9)12(16)18/h2-4,6H,5H2,1H3,(H,19,20)
    Synonyms
    8-Fluoro-5-methyl-6-oxo-5,6-dihydro-4H-benzo[f]imidazo[1,5-a][1,4]diazepine-3-carboxylic acid | DTXSID60233357 | 2- A...
  5. 1'-Hydroxymidazolam
    1'-Hydroxymidazolam
    CAS: 59468-90-5 PubChem CID: 107917 Formula: C18H13ClFN3O Molecular Weight: 341.77
    ≥98%
    Out of Stock Item #: H647302
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    IUPAC Name
    [8-chloro-6-(2-fluorophenyl)-4H-imidazo[1,5-a][1,4]benzodiazepin-1-yl]methanol
    SMILES
    C1C2=CN=C(N2C3=C(C=C(C=C3)Cl)C(=N1)C4=CC=CC=C4F)CO
    InChIKey
    QHSMEGADRFZVNE-UHFFFAOYSA-N
    InChI
    1S/C18H13ClFN3O/c19-11-5-6-16-14(7-11)18(13-3-1-2-4-15(13)20)22-9-12-8-21-17(10-24)23(12)16/h1-8,24H,9-10H2
    Synonyms
    8-Chloro-6-(2-fluorophenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-1-methanol | 1'-Hydroxy Midazolam | MS-25227 | alpha...
  7. no_selection
    Ro15-4513
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools.
    Out of Stock Item #: R613235
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    IUPAC Name
    ethyl 12-azido-8-methyl-9-oxo-2,4,8-triazatricyclo[8.4.0.0^{2,6}]tetradeca-1(10),3,5,11,13-pentaene-5-carboxylate
    SMILES
    CCOC(=O)c1ncn2c1CN(C)C(=O)c1c2ccc(c1)N=[N+]=[N-]
    InChIKey
    CFSOJZTUTOQNIA-UHFFFAOYSA-N
    InChI
    1S/C15H14N6O3/c1-3-24-15(23)13-12-7-20(2)14(22)10-6-9(18-19-16)4-5-11(10)21(12)8-17-13/h4-6,8H,3,7H2,1-2H3
    Synonyms
    BRD-K82823076-001-01-8 | UNII-S5XGL82O5Y | [3H]Ro154513 | [3H]Ro15-4513 | Ro 154513 | Ro 15-4513 | 4H-Imidazo(1,5-a)(...
  8. [¹⁸F]fluoroethylflumazenil - , used for , CAS No. F614015, by Aladdin Scientific
    [¹⁸F]fluoroethylflumazenil
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools.
    Out of Stock Item #: F614015
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    IUPAC Name
    ethyl 8-fluoro-5-(2-fluoroethyl)-6-oxo-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate
    SMILES
    [18F]CCN1Cc2c(ncn2c2c(C1=O)cc(F)cc2)C(=O)OCC
    InChIKey
    NRBIGDVWCXXFLI-SJPDSGJFSA-N
    InChI
    1S/C16H15F2N3O3/c1-2-24-16(23)14-13-8-20(6-5-17)15(22)11-7-10(18)3-4-12(11)21(13)9-19-14/h3-4,7,9H,2,5-6,8H2,1H3/i17-1
    Synonyms
    Fluoroethylflumazenil F-18 | DTXSID80162498 | 3N422P20J8 | SCHEMBL11940819 | UNII-3N422P20J8 | GTPL4368 | ethyl 8-flu...
  9. no_selection
    [¹¹C]flumazenil
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools.
    Out of Stock Item #: C613769
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    Technical Identifiers
    IUPAC Name
    ethyl 8-fluoro-5-methyl-6-oxo-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate
    SMILES
    CCOC(=O)c1ncn2c1CN(C)C(=O)c1c2ccc(c1)F
    InChIKey
    OFBIFZUFASYYRE-UHFFFAOYSA-N
    InChI
    1S/C15H14FN3O3/c1-3-22-15(21)13-12-7-18(2)14(20)10-6-9(16)4-5-11(10)19(12)8-17-13/h4-6,8H,3,7H2,1-2H3
    Synonyms
    Ethyl 8-fluoro-5,6-dihydro-5-methyl-6-oxo-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate | FLUMAZENIL [JAN] | FLU...
  10. no_selection
    [³H]RY80
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools.
    Out of Stock Item #: H614225
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    Technical Identifiers
    IUPAC Name
    ethyl 8-ethynyl-5-methyl-6-oxo-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate
    SMILES
    CCOC(=O)c1ncn2c1CN(C)C(=O)c1c2ccc(c1)C#C
    InChIKey
    WDTNKNNGHGOKBH-UHFFFAOYSA-N
    InChI
    1S/C17H15N3O3/c1-4-11-6-7-13-12(8-11)16(21)19(3)9-14-15(17(22)23-5-2)18-10-20(13)14/h1,6-8,10H,5,9H2,2-3H3
  11. no_selection
    RY024
    CAS: 173990-15-3 PubChem CID: 9927764
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools.
    Out of Stock Item #: R613346
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    Technical Identifiers
    IUPAC Name
    tert-butyl 12-ethynyl-8-methyl-9-oxo-2,4,8-triazatricyclo[8.4.0.0^{2,6}]tetradeca-1(14),3,5,10,12-pentaene-5-carboxylate
    SMILES
    C#Cc1ccc2c(c1)C(=O)N(C)Cc1n2cnc1C(=O)OC(C)(C)C
    InChIKey
    YTUMMZANIYQNOM-UHFFFAOYSA-N
    InChI
    1S/C19H19N3O3/c1-6-12-7-8-14-13(9-12)17(23)21(5)10-15-16(20-11-22(14)15)18(24)25-19(2,3)4/h1,7-9,11H,10H2,2-5H3
    Synonyms
    RY 024;RY-024
  12. no_selection
    RO4938581
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools.
    Out of Stock Item #: R613248
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    Technical Identifiers
    IUPAC Name
    15-bromo-5-(difluoromethyl)-2,4,8,9,11-pentaazatetracyclo[11.4.0.0^{2,6}.0^{8,12}]heptadeca-1(17),3,5,9,11,13,15-heptaene
    SMILES
    Brc1ccc2c(c1)c1ncnn1Cc1n2cnc1C(F)F
    InChIKey
    AFJRYPJIKHMNGL-UHFFFAOYSA-N
    InChI
    1S/C13H8BrF2N5/c14-7-1-2-9-8(3-7)13-17-5-19-21(13)4-10-11(12(15)16)18-6-20(9)10/h1-3,5-6,12H,4H2
    Synonyms
    J-690380 | ZK5NA2M82J | 3-Bromo-10-(difluoromethyl)-9H-imidazo(1,5-a)(1,2,4)triazolo(1,5-d)(1,4)benzodiazepine | AFJR...
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