3-alkylindoles

Description:

Compounds containing an indole moiety that carries an alkyl chain at the 3-position.

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  1. 2,5-Pyrrolidinedione, 3-(5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-1-yl)-4-(1H-indol-3-yl)-, (3S,4S)-
    CAS: 905854-03-7 PubChem CID: 11696354
    Out of Stock Item #: P1057327
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    IUPAC Name
    (3S,4S)-3-(1-azatricyclo[6.3.1.04,12]dodeca-2,4,6,8(12)-tetraen-3-yl)-4-(1H-indol-3-yl)pyrrolidine-2,5-dione
    SMILES
    C1CC2=C3C(=CC=C2)C(=CN3C1)C4C(C(=O)NC4=O)C5=CNC6=CC=CC=C65
    InChIKey
    UCEQXRCJXIVODC-WOJBJXKFSA-N
    InChI
    1S/C23H19N3O2/c27-22-19(16-11-24-18-9-2-1-7-14(16)18)20(23(28)25-22)17-12-26-10-4-6-13-5-3-8-15(17)21(13)26/h1-3,5,7-9,11-12,19-20,24H,4,6,10H2,(H,25,show more
  2. Sari 59-801
    CAS: 80565-58-8 Formula: C18H23N3O2 Molecular Weight: 313.4
    Out of Stock Item #: S1341406
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    IUPAC Name
    2-(dimethylamino)-1-[2-(3-ethyl-5-methyl-1,2-oxazol-4-yl)-1H-indol-3-yl]ethanol
    SMILES
    CCC1=NOC(=C1C2=C(C3=CC=CC=C3N2)C(CN(C)C)O)C
    InChIKey
    GMGOZCSXMVXXRS-UHFFFAOYSA-N
    InChI
    1S/C18H23N3O2/c1-5-13-16(11(2)23-20-13)18-17(15(22)10-21(3)4)12-8-6-7-9-14(12)19-18/h6-9,15,19,22H,5,10H2,1-4H3
  3. N-Desmethyl eletriptan
    CAS: 153525-55-4 PubChem CID: 22873800 Formula: C21H24N2O2S Molecular Weight: 368.49
    Out of Stock Item #: N1013144
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    IUPAC Name
    5-[2-(benzenesulfonyl)ethyl]-3-[[(2R)-pyrrolidin-2-yl]methyl]-1H-indole
    SMILES
    C1CC(NC1)CC2=CNC3=C2C=C(C=C3)CCS(=O)(=O)C4=CC=CC=C4
    InChIKey
    HHTDENYTSCXDFO-GOSISDBHSA-N
    InChI
    1S/C21H24N2O2S/c24-26(25,19-6-2-1-3-7-19)12-10-16-8-9-21-20(13-16)17(15-23-21)14-18-5-4-11-22-18/h1-3,6-9,13,15,18,22-23H,4-5,10-12,14H2/t18-/m1/s1
  4. 2,3-Dihydro-2,3'-bi-1h-indole
    CAS: 6637-10-1 Formula: C16H14N2 Molecular Weight: 234.29
    Out of Stock Item #: D1351086
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    IUPAC Name
    3-(2,3-dihydro-1H-indol-2-yl)-1H-indole
    SMILES
    C1C(NC2=CC=CC=C21)C3=CNC4=CC=CC=C43
    InChIKey
    OGXXVLOAJZDVFY-UHFFFAOYSA-N
    InChI
    1S/C16H14N2/c1-3-7-14-11(5-1)9-16(18-14)13-10-17-15-8-4-2-6-12(13)15/h1-8,10,16-18H,9H2
  5. 3-​(2-​Acetoxyethyl)​-​1H-​indole
    CAS: 13137-14-9 Formula: C12H13NO2 Molecular Weight: 203.2371
    Out of Stock Item #: H769453
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    SMILES
    CC(=O)OCCC1=CNC2=CC=CC=C21
    InChIKey
    KAWBLROQFPLJEU-UHFFFAOYSA-N
    InChI
    1S/C12H13NO2/c1-9(14)15-7-6-10-8-13-12-5-3-2-4-11(10)12/h2-5,8,13H,6-7H2,1H3
  6. 4-(2,3,3-Trimethyl-3H-indol-1-ium-1-yl)butane-1-sulfonate
    CAS: 54136-26-4 PubChem CID: 10447232
    Out of Stock Item #: B770921
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    Technical Identifiers
    IUPAC Name
    4-(2,3,3-trimethylindol-1-ium-1-yl)butane-1-sulfonate
    SMILES
    CC1=[N+](C2=CC=CC=C2C1(C)C)CCCCS(=O)(=O)[O-]
    InChIKey
    XTNXDHCAMPMVRG-UHFFFAOYSA-N
    InChI
    1S/C15H21NO3S/c1-12-15(2,3)13-8-4-5-9-14(13)16(12)10-6-7-11-20(17,18)19/h4-5,8-9H,6-7,10-11H2,1-3H3
  7. 2-(1H-Indol-3-yl)-N,N-dimethylacetamide
    CAS: 91566-04-0 PubChem CID: 582750 Formula: C12H14N2O Molecular Weight: 202.25
    Out of Stock Item #: N768680
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    IUPAC Name
    2-(1H-indol-3-yl)-N,N-dimethylacetamide
    SMILES
    CN(C)C(=O)CC1=CNC2=CC=CC=C21
    InChIKey
    GYOXOOHDSDQLBM-UHFFFAOYSA-N
    InChI
    1S/C12H14N2O/c1-14(2)12(15)7-9-8-13-11-6-4-3-5-10(9)11/h3-6,8,13H,7H2,1-2H3
  8. 5-Fluoro-3-(piperazin-1-ylmethyl)-1H-indole
    CAS: 147595-45-7 PubChem CID: 15646680 Formula: C13H16FN3 Molecular Weight: 233.28
    Liquid ≥97%
    In Stock Item #: F768786
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    Technical Identifiers
    IUPAC Name
    5-fluoro-3-(piperazin-1-ylmethyl)-1H-indole
    SMILES
    C1CN(CCN1)CC2=CNC3=C2C=C(C=C3)F
    InChIKey
    PFOFHPUVOGVDPE-UHFFFAOYSA-N
    InChI
    1S/C13H16FN3/c14-11-1-2-13-12(7-11)10(8-16-13)9-17-5-3-15-4-6-17/h1-2,7-8,15-16H,3-6,9H2
  9. 1H-Indole, 3-methyl-6-nitro-
    CAS: 133053-76-6 PubChem CID: 3358854
    Out of Stock Item #: H769563
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    Technical Identifiers
    IUPAC Name
    3-methyl-6-nitro-1H-indole
    SMILES
    CC1=CNC2=C1C=CC(=C2)[N+](=O)[O-]
    InChIKey
    FXOBRUMCGPOJLL-UHFFFAOYSA-N
    InChI
    1S/C9H8N2O2/c1-6-5-10-9-4-7(11(12)13)2-3-8(6)9/h2-5,10H,1H3
  10. N-(2-(1H-Indol-3-yl)ethyl)-2,2,2-trifluoroacetamide
    CAS: 319-76-6 PubChem CID: 384618 Formula: C12H11F3N2O Molecular Weight: 256.23
    Out of Stock Item #: N735240
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    IUPAC Name
    2,2,2-trifluoro-N-[2-(1H-indol-3-yl)ethyl]acetamide
    SMILES
    C1=CC=C2C(=C1)C(=CN2)CCNC(=O)C(F)(F)F
    InChIKey
    KDFCROJYVJQVQK-UHFFFAOYSA-N
    InChI
    1S/C12H11F3N2O/c13-12(14,15)11(18)16-6-5-8-7-17-10-4-2-1-3-9(8)10/h1-4,7,17H,5-6H2,(H,16,18)
  11. 4-Fluoro-3-(piperidin-4-yl)-1H-indole
    CAS: 173150-61-3 PubChem CID: 15337634 Formula: C13H15FN2 Molecular Weight: 218.275
    Out of Stock Item #: F728366
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    Technical Identifiers
    IUPAC Name
    4-fluoro-3-piperidin-4-yl-1H-indole
    SMILES
    C1CNCCC1C2=CNC3=C2C(=CC=C3)F
    InChIKey
    DEIYMTQMNDLJHX-UHFFFAOYSA-N
    InChI
    1S/C13H15FN2/c14-11-2-1-3-12-13(11)10(8-16-12)9-4-6-15-7-5-9/h1-3,8-9,15-16H,4-7H2
  12. 3-(Trifluoromethyl)-1H-indole
    CAS: 51310-55-5 PubChem CID: 13152885 Formula: C9H6F3N Molecular Weight: 185.15
    Out of Stock Item #: H727342
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    Technical Identifiers
    IUPAC Name
    3-(trifluoromethyl)-1H-indole
    SMILES
    C1=CC=C2C(=C1)C(=CN2)C(F)(F)F
    InChIKey
    CLSZROKTPWVQKB-UHFFFAOYSA-N
    InChI
    1S/C9H6F3N/c10-9(11,12)7-5-13-8-4-2-1-3-6(7)8/h1-5,13H
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