[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl] 2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]ethanoate

Systemtic Name: [2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl] 2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]ethanoate Openeye Name: [2-(3-methylanilino)-2-oxo-ethyl] 2-[(5-acetyl-2-methoxy-phenyl)methylsulfanyl]acetate CAS Name: 2-[(5-acetyl-2-methoxyphenyl)methylthio]acetic acid [2-(3-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-methylanilino)-2-oxoethyl] 2-[(5-acetyl-2-methoxyphenyl)methylsulfanyl]acetate Traditional Name: 2-[(5-acetyl-2-methoxy-benzyl)thio]acetic acid [2-keto-2-(m-toluidino)ethyl] ester Formula: C21H23NO5S MolecularWeight: 401.47602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)COC(=O)CSCC2=C(C=CC(=C2)C(=O)C)OC

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)COC(=O)CSCC2=C(C=CC(=C2)C(=O)C)OC

InChI

InChI=1S/C21H23NO5S/c1-14-5-4-6-18(9-14)22-20(24)11-27-21(25)13-28-12-17-10-16(15(2)23)7-8-19(17)26-3/h4-10H,11-13H2,1-3H3,(H,22,24)