4-[[3,6-bis[3-(dimethylamino)-3-oxidanylidene-propyl]indol-1-yl]methyl]-3-methoxy-N-(2-methylphenyl)sulfonyl-benzamide

Systemtic Name: 4-[[3,6-bis[3-(dimethylamino)-3-oxidanylidene-propyl]indol-1-yl]methyl]-3-methoxy-N-(2-methylphenyl)sulfonyl-benzamide Openeye Name: 4-[[3,6-bis[3-(dimethylamino)-3-oxo-propyl]indol-1-yl]methyl]-3-methoxy-N-(o-tolylsulfonyl)benzamide CAS Name: 4-[[3,6-bis[3-(dimethylamino)-3-oxopropyl]-1-indolyl]methyl]-3-methoxy-N-(2-methylphenyl)sulfonylbenzamide IUPAC Name: 4-[[3,6-bis[3-(dimethylamino)-3-oxopropyl]indol-1-yl]methyl]-3-methoxy-N-(2-methylphenyl)sulfonylbenzamide Traditional Name: 4-[[3,6-bis[3-(dimethylamino)-3-keto-propyl]indol-1-yl]methyl]-3-methoxy-N-(o-tolylsulfonyl)benzamide Formula: C34H40N4O6S MolecularWeight: 632.7696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1S(=O)(=O)NC(=O)C2=CC(=C(C=C2)CN3C=C(C4=C3C=C(C=C4)CCC(=O)N(C)C)CCC(=O)N(C)C)OC

Isomeric SMILES

CC1=CC=CC=C1S(=O)(=O)NC(=O)C2=CC(=C(C=C2)CN3C=C(C4=C3C=C(C=C4)CCC(=O)N(C)C)CCC(=O)N(C)C)OC

InChI

InChI=1S/C34H40N4O6S/c1-23-9-7-8-10-31(23)45(42,43)35-34(41)25-13-14-27(30(20-25)44-6)22-38-21-26(15-18-33(40)37(4)5)28-16-11-24(19-29(28)38)12-17-32(39)36(2)3/h7-11,13-14,16,19-21H,12,15,17-18,22H2,1-6H3,(H,35,41)