[1-[(2-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(4-bromanyl-2-methyl-phenyl)sulfanylethanoate

Systemtic Name: [1-[(2-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(4-bromanyl-2-methyl-phenyl)sulfanylethanoate Openeye Name: [1-methyl-2-(2-methylanilino)-2-oxo-ethyl] 2-(4-bromo-2-methyl-phenyl)sulfanylacetate CAS Name: 2-[(4-bromo-2-methylphenyl)thio]acetic acid [1-(2-methylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-methylanilino)-1-oxopropan-2-yl] 2-(4-bromo-2-methylphenyl)sulfanylacetate Traditional Name: 2-[(4-bromo-2-methyl-phenyl)thio]acetic acid [2-keto-1-methyl-2-(o-toluidino)ethyl] ester Formula: C19H20BrNO3S MolecularWeight: 422.336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C(C)OC(=O)CSC2=C(C=C(C=C2)Br)C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C(C)OC(=O)CSC2=C(C=C(C=C2)Br)C

InChI

InChI=1S/C19H20BrNO3S/c1-12-6-4-5-7-16(12)21-19(23)14(3)24-18(22)11-25-17-9-8-15(20)10-13(17)2/h4-10,14H,11H2,1-3H3,(H,21,23)