[2-[(2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 3-phenylsulfanylpropanoate

Systemtic Name: [2-[(2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 3-phenylsulfanylpropanoate Openeye Name: [2-(2-methoxy-5-methyl-anilino)-2-oxo-ethyl] 3-phenylsulfanylpropanoate CAS Name: 3-(phenylthio)propanoic acid [2-(2-methoxy-5-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-methoxy-5-methylanilino)-2-oxoethyl] 3-phenylsulfanylpropanoate Traditional Name: 3-(phenylthio)propionic acid [2-keto-2-(2-methoxy-5-methyl-anilino)ethyl] ester Formula: C19H21NO4S MolecularWeight: 359.43934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)COC(=O)CCSC2=CC=CC=C2

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)COC(=O)CCSC2=CC=CC=C2

InChI

InChI=1S/C19H21NO4S/c1-14-8-9-17(23-2)16(12-14)20-18(21)13-24-19(22)10-11-25-15-6-4-3-5-7-15/h3-9,12H,10-11,13H2,1-2H3,(H,20,21)