methyl 2-[(3-acetyloxy-2-methyl-phenyl)carbonylamino]-3-phenylsulfanyl-propanoate

Systemtic Name: methyl 2-[(3-acetyloxy-2-methyl-phenyl)carbonylamino]-3-phenylsulfanyl-propanoate Openeye Name: methyl 2-[(3-acetoxy-2-methyl-benzoyl)amino]-3-phenylsulfanyl-propanoate CAS Name: 2-[[(3-acetyloxy-2-methylphenyl)-oxomethyl]amino]-3-(phenylthio)propanoic acid methyl ester IUPAC Name: methyl 2-[(3-acetyloxy-2-methylbenzoyl)amino]-3-phenylsulfanylpropanoate Traditional Name: 2-[(3-acetoxy-2-methyl-benzoyl)amino]-3-(phenylthio)propionic acid methyl ester Formula: C20H21NO5S MolecularWeight: 387.44944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1OC(=O)C)C(=O)NC(CSC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC1=C(C=CC=C1OC(=O)C)C(=O)NC(CSC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C20H21NO5S/c1-13-16(10-7-11-18(13)26-14(2)22)19(23)21-17(20(24)25-3)12-27-15-8-5-4-6-9-15/h4-11,17H,12H2,1-3H3,(H,21,23)