ethyl 2-acetamido-3-ethanoylsulfanyl-3-(1H-indol-3-yl)propanoate

Systemtic Name: ethyl 2-acetamido-3-ethanoylsulfanyl-3-(1H-indol-3-yl)propanoate Openeye Name: ethyl 2-acetamido-3-acetylsulfanyl-3-(1H-indol-3-yl)propanoate CAS Name: 2-acetamido-3-(acetylthio)-3-(1H-indol-3-yl)propanoic acid ethyl ester IUPAC Name: ethyl 2-acetamido-3-acetylsulfanyl-3-(1H-indol-3-yl)propanoate Traditional Name: 2-acetamido-3-(acetylthio)-3-(1H-indol-3-yl)propionic acid ethyl ester Formula: C17H20N2O4S MolecularWeight: 348.4167

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1=CNC2=CC=CC=C21)SC(=O)C)NC(=O)C

Isomeric SMILES

CCOC(=O)C(C(C1=CNC2=CC=CC=C21)SC(=O)C)NC(=O)C

InChI

InChI=1S/C17H20N2O4S/c1-4-23-17(22)15(19-10(2)20)16(24-11(3)21)13-9-18-14-8-6-5-7-12(13)14/h5-9,15-16,18H,4H2,1-3H3,(H,19,20)