N-[2-(1H-indol-3-yl)-2-phenyl-ethyl]-2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-propanamide

Systemtic Name: N-[2-(1H-indol-3-yl)-2-phenyl-ethyl]-2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-propanamide Openeye Name: N-[2-(1H-indol-3-yl)-2-phenyl-ethyl]-2-[2-(4-methylanilino)-2-oxo-ethyl]sulfanyl-propanamide CAS Name: N-[2-(1H-indol-3-yl)-2-phenylethyl]-2-[[2-(4-methylanilino)-2-oxoethyl]thio]propanamide IUPAC Name: N-[2-(1H-indol-3-yl)-2-phenylethyl]-2-[2-(4-methylanilino)-2-oxoethyl]sulfanylpropanamide Traditional Name: N-[2-(1H-indol-3-yl)-2-phenyl-ethyl]-2-[[2-keto-2-(p-toluidino)ethyl]thio]propionamide Formula: C28H29N3O2S MolecularWeight: 471.61376

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H29N3O2S/c1-19-12-14-22(15-13-19)31-27(32)18-34-20(2)28(33)30-16-24(21-8-4-3-5-9-21)25-17-29-26-11-7-6-10-23(25)26/h3-15,17,20,24,29H,16,18H2,1-2H3,(H,30,33)(H,31,32)