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

Systemtic Name: 4-[[5-[2-(butylamino)-2-oxidanylidene-ethyl]-1-prop-2-enyl-indol-3-yl]methyl]-3-methoxy-N-(2-methylphenyl)sulfonyl-benzamide Openeye Name: 4-[[1-allyl-5-[2-(butylamino)-2-oxo-ethyl]indol-3-yl]methyl]-3-methoxy-N-(o-tolylsulfonyl)benzamide CAS Name: 4-[[5-[2-(butylamino)-2-oxoethyl]-1-prop-2-enyl-3-indolyl]methyl]-3-methoxy-N-(2-methylphenyl)sulfonylbenzamide IUPAC Name: 4-[[5-[2-(butylamino)-2-oxoethyl]-1-prop-2-enylindol-3-yl]methyl]-3-methoxy-N-(2-methylphenyl)sulfonylbenzamide Traditional Name: 4-[[1-allyl-5-[2-(butylamino)-2-keto-ethyl]indol-3-yl]methyl]-3-methoxy-N-(o-tolylsulfonyl)benzamide Formula: C33H37N3O5S MolecularWeight: 587.72898

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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)CC=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)CC=C

InChI

InChI=1S/C33H37N3O5S/c1-5-7-16-34-32(37)19-24-12-15-29-28(18-24)27(22-36(29)17-6-2)20-25-13-14-26(21-30(25)41-4)33(38)35-42(39,40)31-11-9-8-10-23(31)3/h6,8-15,18,21-22H,2,5,7,16-17,19-20H2,1,3-4H3,(H,34,37)(H,35,38)