methyl 3-[(2-chloranyl-5-methylsulfanyl-phenyl)carbonylamino]-3-(4-methylphenyl)propanoate

Systemtic Name: methyl 3-[(2-chloranyl-5-methylsulfanyl-phenyl)carbonylamino]-3-(4-methylphenyl)propanoate Openeye Name: methyl 3-[(2-chloro-5-methylsulfanyl-benzoyl)amino]-3-(p-tolyl)propanoate CAS Name: 3-[[[2-chloro-5-(methylthio)phenyl]-oxomethyl]amino]-3-(4-methylphenyl)propanoic acid methyl ester IUPAC Name: methyl 3-[(2-chloro-5-methylsulfanylbenzoyl)amino]-3-(4-methylphenyl)propanoate Traditional Name: 3-[[2-chloro-5-(methylthio)benzoyl]amino]-3-(p-tolyl)propionic acid methyl ester Formula: C19H20ClNO3S MolecularWeight: 377.885

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CC(=O)OC)NC(=O)C2=C(C=CC(=C2)SC)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C(CC(=O)OC)NC(=O)C2=C(C=CC(=C2)SC)Cl

InChI

InChI=1S/C19H20ClNO3S/c1-12-4-6-13(7-5-12)17(11-18(22)24-2)21-19(23)15-10-14(25-3)8-9-16(15)20/h4-10,17H,11H2,1-3H3,(H,21,23)