[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl] 2-(4-bromophenyl)sulfanylethanoate

Systemtic Name: [2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl] 2-(4-bromophenyl)sulfanylethanoate Openeye Name: [2-(2-methylanilino)-2-oxo-ethyl] 2-(4-bromophenyl)sulfanylacetate CAS Name: 2-[(4-bromophenyl)thio]acetic acid [2-(2-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-methylanilino)-2-oxoethyl] 2-(4-bromophenyl)sulfanylacetate Traditional Name: 2-[(4-bromophenyl)thio]acetic acid [2-keto-2-(o-toluidino)ethyl] ester Formula: C17H16BrNO3S MolecularWeight: 394.28284

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16BrNO3S/c1-12-4-2-3-5-15(12)19-16(20)10-22-17(21)11-23-14-8-6-13(18)7-9-14/h2-9H,10-11H2,1H3,(H,19,20)