[1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl] 3-phenylsulfanylpropanoate

Systemtic Name: [1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl] 3-phenylsulfanylpropanoate Openeye Name: [2-(1H-indol-3-yl)-1-methyl-2-oxo-ethyl] 3-phenylsulfanylpropanoate CAS Name: 3-(phenylthio)propanoic acid [1-(1H-indol-3-yl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(1H-indol-3-yl)-1-oxopropan-2-yl] 3-phenylsulfanylpropanoate Traditional Name: 3-(phenylthio)propionic acid [2-(1H-indol-3-yl)-2-keto-1-methyl-ethyl] ester Formula: C20H19NO3S MolecularWeight: 353.43476

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CNC2=CC=CC=C21)OC(=O)CCSC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)C1=CNC2=CC=CC=C21)OC(=O)CCSC3=CC=CC=C3

InChI

InChI=1S/C20H19NO3S/c1-14(20(23)17-13-21-18-10-6-5-9-16(17)18)24-19(22)11-12-25-15-7-3-2-4-8-15/h2-10,13-14,21H,11-12H2,1H3