(1-oxidanylidene-1-phenylazanyl-propan-2-yl) 3-phenylsulfanylpropanoate

Systemtic Name: (1-oxidanylidene-1-phenylazanyl-propan-2-yl) 3-phenylsulfanylpropanoate Openeye Name: (2-anilino-1-methyl-2-oxo-ethyl) 3-phenylsulfanylpropanoate CAS Name: 3-(phenylthio)propanoic acid (1-anilino-1-oxopropan-2-yl) ester IUPAC Name: (1-anilino-1-oxopropan-2-yl) 3-phenylsulfanylpropanoate Traditional Name: 3-(phenylthio)propionic acid (2-anilino-2-keto-1-methyl-ethyl) ester Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)OC(=O)CCSC2=CC=CC=C2

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1)OC(=O)CCSC2=CC=CC=C2

InChI

InChI=1S/C18H19NO3S/c1-14(18(21)19-15-8-4-2-5-9-15)22-17(20)12-13-23-16-10-6-3-7-11-16/h2-11,14H,12-13H2,1H3,(H,19,21)