[2-oxidanylidene-2-[(2-phenylsulfanylphenyl)amino]ethyl] 3-(1H-indol-3-yl)propanoate

Systemtic Name: [2-oxidanylidene-2-[(2-phenylsulfanylphenyl)amino]ethyl] 3-(1H-indol-3-yl)propanoate Openeye Name: [2-oxo-2-(2-phenylsulfanylanilino)ethyl] 3-(1H-indol-3-yl)propanoate CAS Name: 3-(1H-indol-3-yl)propanoic acid [2-oxo-2-[2-(phenylthio)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(2-phenylsulfanylanilino)ethyl] 3-(1H-indol-3-yl)propanoate Traditional Name: 3-(1H-indol-3-yl)propionic acid [2-keto-2-[2-(phenylthio)anilino]ethyl] ester Formula: C25H22N2O3S MolecularWeight: 430.51878

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=CC=CC=C2NC(=O)COC(=O)CCC3=CNC4=CC=CC=C43

Isomeric SMILES

C1=CC=C(C=C1)SC2=CC=CC=C2NC(=O)COC(=O)CCC3=CNC4=CC=CC=C43

InChI

InChI=1S/C25H22N2O3S/c28-24(27-22-12-6-7-13-23(22)31-19-8-2-1-3-9-19)17-30-25(29)15-14-18-16-26-21-11-5-4-10-20(18)21/h1-13,16,26H,14-15,17H2,(H,27,28)