methyl 2-[4-[(3-methylphenyl)carbonylamino]phenyl]sulfanylethanoate

Systemtic Name: methyl 2-[4-[(3-methylphenyl)carbonylamino]phenyl]sulfanylethanoate Openeye Name: methyl 2-[4-[(3-methylbenzoyl)amino]phenyl]sulfanylacetate CAS Name: 2-[[4-[[(3-methylphenyl)-oxomethyl]amino]phenyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[4-[(3-methylbenzoyl)amino]phenyl]sulfanylacetate Traditional Name: 2-[[4-(m-toluoylamino)phenyl]thio]acetic acid methyl ester Formula: C17H17NO3S MolecularWeight: 315.38678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)SCC(=O)OC

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)SCC(=O)OC

InChI

InChI=1S/C17H17NO3S/c1-12-4-3-5-13(10-12)17(20)18-14-6-8-15(9-7-14)22-11-16(19)21-2/h3-10H,11H2,1-2H3,(H,18,20)