1,2,4-benzothiadiazine-1,1-dioxides

Description:

Aromatic heterocyclic compounds containing a 1,2,4-benzothiadiazine ring system with two S=O bonds at the 1-position.

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  1. Setrobuvir
    CAS: 1071517-39-9 PubChem CID: 135565932
    Out of Stock Item #: S1340786
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    Technical Identifiers
    IUPAC Name
    N-[3-[(1R,2S,7R,8S)-3-[(4-fluorophenyl)methyl]-6-hydroxy-4-oxo-3-azatricyclo[6.2.1.02,7]undec-5-en-5-yl]-1,1-dioxo-4H-1\u03bb6,2,4-benzothiadiazin-7-yshow more
    SMILES
    CS(=O)(=O)NC1=CC2=C(C=C1)NC(=NS2(=O)=O)C3=C(C4C5CCC(C5)C4N(C3=O)CC6=CC=C(C=C6)F)O
    InChIKey
    DEKOYVOWOVJMPM-RLHIPHHXSA-N
    InChI
    1S/C25H25FN4O6S2/c1-37(33,34)28-17-8-9-18-19(11-17)38(35,36)29-24(27-18)21-23(31)20-14-4-5-15(10-14)22(20)30(25(21)32)12-13-2-6-16(26)7-3-13/h2-3,6-9,show more
  2. DU 717
    CAS: 59943-31-6 PubChem CID: 43148
    Out of Stock Item #: D1318467
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    IUPAC Name
    7-chloro-3-(4-methylpiperazin-1-yl)-4H-1\u03bb6,2,4-benzothiadiazine 1,1-dioxide
    SMILES
    CN1CCN(CC1)C2=NS(=O)(=O)C3=C(N2)C=CC(=C3)Cl
    InChIKey
    JPZVJONKWYICFB-UHFFFAOYSA-N
    InChI
    1S/C12H15ClN4O2S/c1-16-4-6-17(7-5-16)12-14-10-3-2-9(13)8-11(10)20(18,19)15-12/h2-3,8H,4-7H2,1H3,(H,14,15)
  3. 4-Cyclopropyl-7-Fluoro-3,4-Dihydro-2h-1,2,4-Benzothiadiazine 1,1-Dioxide
    CAS: 1204572-55-3 PubChem CID: 67531324 Formula: C10H11FN2O2S Molecular Weight: 242.27
    Out of Stock Item #: C1313540
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    IUPAC Name
    4-cyclopropyl-7-fluoro-2,3-dihydro-1λ6,2,4-benzothiadiazine 1,1-dioxide
    SMILES
    C1CC1N2CNS(=O)(=O)C3=C2C=CC(=C3)F
    InChIKey
    FLTMTBPCYAZIKM-UHFFFAOYSA-N
    InChI
    1S/C10H11FN2O2S/c11-7-1-4-9-10(5-7)16(14,15)12-6-13(9)8-2-3-8/h1,4-5,8,12H,2-3,6H2
  4. Epithiazide
    CAS: 1764-85-8 PubChem CID: 15671 Formula: C10H11ClF3N3O4S3 Molecular Weight: 425.86
    Out of Stock Item #: E1360418
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    IUPAC Name
    6-chloro-1,1-dioxo-3-(2,2,2-trifluoroethylsulfanylmethyl)-3,4-dihydro-2H-1λ6,2,4-benzothiadiazine-7-sulfonamide
    SMILES
    C1=C2C(=CC(=C1Cl)S(=O)(=O)N)S(=O)(=O)NC(N2)CSCC(F)(F)F
    InChIKey
    RINBGYCKMGDWPY-UHFFFAOYSA-N
    InChI
    1S/C10H11ClF3N3O4S3/c11-5-1-6-8(2-7(5)23(15,18)19)24(20,21)17-9(16-6)3-22-4-10(12,13)14/h1-2,9,16-17H,3-4H2,(H2,15,18,19)
  5. 7-fluoro-4H-1,2,4-benzothiadiazine 1,1-dioxide
    CAS: 37162-45-1 PubChem CID: 16732466 Formula: C7H5FN2O2S Molecular Weight: 200.19
    Out of Stock Item #: F681622
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    Technical Identifiers
    SMILES
    C1=CC2=C(C=C1F)S(=O)(=O)N=CN2
    InChIKey
    GGUYGZYFOLFKHT-UHFFFAOYSA-N
    InChI
    1S/C7H5FN2O2S/c8-5-1-2-6-7(3-5)13(11,12)10-4-9-6/h1-4H,(H,9,10)
  6. Chlorothiazide sodium
    CAS: 7085-44-1 PubChem CID: 23675744 Formula: C7H5ClN3NaO4S2 Molecular Weight: 317.7
    Out of Stock Item #: C671158
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    IUPAC Name
    sodium;6-chloro-1,1-dioxo-1lambda6,2,4-benzothiadiazin-2-ide-7-sulfonamide
    SMILES
    C1=C2C(=CC(=C1Cl)S(=O)(=O)N)S(=O)(=O)[N-]C=N2.[Na+]
    InChIKey
    CPIWHAFLBZQYLQ-UHFFFAOYSA-N
    InChI
    1S/C7H5ClN3O4S2.Na/c8-4-1-5-7(2-6(4)16(9,12)13)17(14,15)11-3-10-5;/h1-3H,(H2-,9,10,11,12,13);/q-1;+1
    Synonyms
    CHLOROTHIAZIDE SODIUM | CHLOROTHIAZIDE SODIUM [VANDF] | CHLOROTHIAZIDE SODIUM [MART.] | Chlorothiazide sodium [USAN:U...
  7. Mebetide
    CAS: 360-81-6 PubChem CID: 67760 Formula: C8H8N2O2S Molecular Weight: 196.23
    Out of Stock Item #: M667942
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    Technical Identifiers
    IUPAC Name
    3-methyl-4H-1lambda6,2,4-benzothiadiazine 1,1-dioxide
    SMILES
    CC1=NS(=O)(=O)C2=CC=CC=C2N1
    InChIKey
    FDWRKMPNEIXNOE-UHFFFAOYSA-N
    InChI
    1S/C8H8N2O2S/c1-6-9-7-4-2-3-5-8(7)13(11,12)10-6/h2-5H,1H3,(H,9,10)
    Synonyms
    Mebetide | 3-methyl-4H-1lambda6,2,4-benzothiadiazine 1,1-dioxide | 3-methyl-4h-1,2,4-benzothiadiazine 1,1-dioxide | 3...
  8. 7-Fluoro-2H-benzo[e][1,2,4]thiadiazin-3(4H)-one 1,1-dioxide
    CAS: 152721-97-6 PubChem CID: 11096006 Formula: C7H5FN2O3S Molecular Weight: 216.19
    Out of Stock Item #: F669119
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    Technical Identifiers
    IUPAC Name
    7-fluoro-1,1-dioxo-4H-1lambda6,2,4-benzothiadiazin-3-one
    SMILES
    C1=CC2=C(C=C1F)S(=O)(=O)NC(=O)N2
    InChIKey
    ITUAGWGFDMMEMY-UHFFFAOYSA-N
    InChI
    1S/C7H5FN2O3S/c8-4-1-2-5-6(3-4)14(12,13)10-7(11)9-5/h1-3H,(H2,9,10,11)
    Synonyms
    7-Fluoro-2H-benzo[e][1,2,4]thiadiazin-3(4H)-one 1,1-dioxide | 7-fluoro-1,1-dioxo-4H-1lambda6,2,4-benzothiadiazin-3-on...
  9. 4-methyl-3,4-dihydro-2H-1lambda6,2,4-benzothiadiazine-1,1,3-trione
    CAS: 13338-02-8 PubChem CID: 11615432 Formula: C8H8N2O3S Molecular Weight: 212.23
    Out of Stock Item #: M669154
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    Technical Identifiers
    IUPAC Name
    4-methyl-1,1-dioxo-1lambda6,2,4-benzothiadiazin-3-one
    SMILES
    CN1C2=CC=CC=C2S(=O)(=O)NC1=O
    InChIKey
    RQCMUVKZNMGOOY-UHFFFAOYSA-N
    InChI
    1S/C8H8N2O3S/c1-10-6-4-2-3-5-7(6)14(12,13)9-8(10)11/h2-5H,1H3,(H,9,11)
    Synonyms
    4-methyl-3,4-dihydro-2H-1lambda6,2,4-benzothiadiazine-1,1,3-trione | 4-methyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2...
  10. 5-Bromo-2H-benzo[e][1,2,4]thiadiazin-3(4H)-one 1,1-dioxide
    CAS: 155983-98-5 PubChem CID: 10016330 Formula: C7H5BrN2O3S Molecular Weight: 277.1
    Out of Stock Item #: B669060
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    Technical Identifiers
    IUPAC Name
    5-bromo-1,1-dioxo-4H-1lambda6,2,4-benzothiadiazin-3-one
    SMILES
    C1=CC2=C(C(=C1)Br)NC(=O)NS2(=O)=O
    InChIKey
    UNWFVIMGKIDJKB-UHFFFAOYSA-N
    InChI
    1S/C7H5BrN2O3S/c8-4-2-1-3-5-6(4)9-7(11)10-14(5,12)13/h1-3H,(H2,9,10,11)
    Synonyms
    5-Bromo-2H-benzo[e][1,2,4]thiadiazin-3(4H)-one 1,1-dioxide | MFCD28991884 | 5-bromo-1,1-dioxo-4H-1lambda6,2,4-benzoth...
  11. 2H-1,2,4-Benzothiadiazin-3(4H)-one, 7-methyl-, 1,1-dioxide
    CAS: 71254-63-2 PubChem CID: 10081897 Formula: C8H8N2O3S Molecular Weight: 212.23
    Out of Stock Item #: H669065
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    Technical Identifiers
    IUPAC Name
    7-methyl-1,1-dioxo-4H-1lambda6,2,4-benzothiadiazin-3-one
    SMILES
    CC1=CC2=C(C=C1)NC(=O)NS2(=O)=O
    InChIKey
    ZZPWPCXHSCJIEN-UHFFFAOYSA-N
    InChI
    1S/C8H8N2O3S/c1-5-2-3-6-7(4-5)14(12,13)10-8(11)9-6/h2-4H,1H3,(H2,9,10,11)
    Synonyms
    2H-1,2,4-Benzothiadiazin-3(4H)-one, 7-methyl-, 1,1-dioxide | 7-Methyl-1,1-dioxo-1,4-dihydro-2H-1 | 7-methyl-1,1-dioxo...
  12. Hydrochlorothiazid-13C,d2
    CAS: 1190006-03-1 Formula: C613CH6D2ClN3O4S2 Molecular Weight: 300.74
    Out of Stock Item #: H648145
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    Technical Identifiers
    IUPAC Name
    6-chloro-3,3-dideuterio-1,1-dioxo-2,4-dihydro-1\u03bb6,2,4-benzothiadiazine-7-sulfonamide
    SMILES
    C1NC2=CC(=C(C=C2S(=O)(=O)N1)S(=O)(=O)N)Cl
    InChIKey
    JZUFKLXOESDKRF-QFNKQLDQSA-N
    InChI
    1S/C7H8ClN3O4S2/c8-4-1-5-7(2-6(4)16(9,12)13)17(14,15)11-3-10-5/h1-2,10-11H,3H2,(H2,9,12,13)/i3+1D2
    Synonyms
    HY-B0252S1 | Hydrochlorothiazide-13C,d2 | 1190006-03-1 | Hydrochlorothiazid-13C,d2 | 6-Chloro-1,1-dioxo(3-~13~C,3,3-~...
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