4-[[5-[2-(butylamino)-2-oxidanylidene-ethyl]-1-methyl-indol-3-yl]methyl]-3-methoxy-N-(2-methylphenyl)sulfonyl-benzamide

Systemtic Name: 4-[[5-[2-(butylamino)-2-oxidanylidene-ethyl]-1-methyl-indol-3-yl]methyl]-3-methoxy-N-(2-methylphenyl)sulfonyl-benzamide Openeye Name: 4-[[5-[2-(butylamino)-2-oxo-ethyl]-1-methyl-indol-3-yl]methyl]-3-methoxy-N-(o-tolylsulfonyl)benzamide CAS Name: 4-[[5-[2-(butylamino)-2-oxoethyl]-1-methyl-3-indolyl]methyl]-3-methoxy-N-(2-methylphenyl)sulfonylbenzamide IUPAC Name: 4-[[5-[2-(butylamino)-2-oxoethyl]-1-methylindol-3-yl]methyl]-3-methoxy-N-(2-methylphenyl)sulfonylbenzamide Traditional Name: 4-[[5-[2-(butylamino)-2-keto-ethyl]-1-methyl-indol-3-yl]methyl]-3-methoxy-N-(o-tolylsulfonyl)benzamide Formula: C31H35N3O5S MolecularWeight: 561.6917

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CC1=CC2=C(C=C1)N(C=C2CC3=C(C=C(C=C3)C(=O)NS(=O)(=O)C4=CC=CC=C4C)OC)C

Isomeric SMILES

CCCCNC(=O)CC1=CC2=C(C=C1)N(C=C2CC3=C(C=C(C=C3)C(=O)NS(=O)(=O)C4=CC=CC=C4C)OC)C

InChI

InChI=1S/C31H35N3O5S/c1-5-6-15-32-30(35)17-22-11-14-27-26(16-22)25(20-34(27)3)18-23-12-13-24(19-28(23)39-4)31(36)33-40(37,38)29-10-8-7-9-21(29)2/h7-14,16,19-20H,5-6,15,17-18H2,1-4H3,(H,32,35)(H,33,36)