N-[2-(1H-indol-3-yl)-2-phenyl-ethyl]-2-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-ethanamide

Systemtic Name: N-[2-(1H-indol-3-yl)-2-phenyl-ethyl]-2-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-ethanamide Openeye Name: N-[2-(1H-indol-3-yl)-2-phenyl-ethyl]-2-[2-(3-methylanilino)-2-oxo-ethyl]sulfanyl-acetamide CAS Name: N-[2-(1H-indol-3-yl)-2-phenylethyl]-2-[[2-(3-methylanilino)-2-oxoethyl]thio]acetamide IUPAC Name: N-[2-(1H-indol-3-yl)-2-phenylethyl]-2-[2-(3-methylanilino)-2-oxoethyl]sulfanylacetamide Traditional Name: N-[2-(1H-indol-3-yl)-2-phenyl-ethyl]-2-[[2-keto-2-(m-toluidino)ethyl]thio]acetamide Formula: C27H27N3O2S MolecularWeight: 457.58718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CSCC(=O)NCC(C2=CC=CC=C2)C3=CNC4=CC=CC=C43

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CSCC(=O)NCC(C2=CC=CC=C2)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C27H27N3O2S/c1-19-8-7-11-21(14-19)30-27(32)18-33-17-26(31)29-15-23(20-9-3-2-4-10-20)24-16-28-25-13-6-5-12-22(24)25/h2-14,16,23,28H,15,17-18H2,1H3,(H,29,31)(H,30,32)