[2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] 2-phenylsulfanylpropanoate

Systemtic Name: [2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] 2-phenylsulfanylpropanoate Openeye Name: [2-(cyclopropylamino)-2-oxo-1-phenyl-ethyl] 2-phenylsulfanylpropanoate CAS Name: 2-(phenylthio)propanoic acid [2-(cyclopropylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(cyclopropylamino)-2-oxo-1-phenylethyl] 2-phenylsulfanylpropanoate Traditional Name: 2-(phenylthio)propionic acid [2-(cyclopropylamino)-2-keto-1-phenyl-ethyl] ester Formula: C20H21NO3S MolecularWeight: 355.45064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC(C1=CC=CC=C1)C(=O)NC2CC2)SC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)OC(C1=CC=CC=C1)C(=O)NC2CC2)SC3=CC=CC=C3

InChI

InChI=1S/C20H21NO3S/c1-14(25-17-10-6-3-7-11-17)20(23)24-18(15-8-4-2-5-9-15)19(22)21-16-12-13-16/h2-11,14,16,18H,12-13H2,1H3,(H,21,22)