2-[(4-bromophenyl)sulfonyl-cyclopropyl-amino]-N-[(3,4-dimethoxyphenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]ethanamide

Systemtic Name: 2-[(4-bromophenyl)sulfonyl-cyclopropyl-amino]-N-[(3,4-dimethoxyphenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]ethanamide Openeye Name: 2-[(4-bromophenyl)sulfonyl-cyclopropyl-amino]-N-[(3,4-dimethoxyphenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]acetamide CAS Name: 2-[(4-bromophenyl)sulfonyl-cyclopropylamino]-N-[(3,4-dimethoxyphenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]acetamide IUPAC Name: 2-[(4-bromophenyl)sulfonyl-cyclopropylamino]-N-[(3,4-dimethoxyphenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]acetamide Traditional Name: 2-[brosyl(cyclopropyl)amino]-N-[2-(1H-indol-3-yl)ethyl]-N-veratryl-acetamide Formula: C30H32BrN3O5S MolecularWeight: 626.56118

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN(CCC2=CNC3=CC=CC=C32)C(=O)CN(C4CC4)S(=O)(=O)C5=CC=C(C=C5)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN(CCC2=CNC3=CC=CC=C32)C(=O)CN(C4CC4)S(=O)(=O)C5=CC=C(C=C5)Br)OC

InChI

InChI=1S/C30H32BrN3O5S/c1-38-28-14-7-21(17-29(28)39-2)19-33(16-15-22-18-32-27-6-4-3-5-26(22)27)30(35)20-34(24-10-11-24)40(36,37)25-12-8-23(31)9-13-25/h3-9,12-14,17-18,24,32H,10-11,15-16,19-20H2,1-2H3