[2-[(4-bromophenyl)amino]-2-oxidanylidene-ethyl] 2-methylsulfanylbenzoate

Systemtic Name: [2-[(4-bromophenyl)amino]-2-oxidanylidene-ethyl] 2-methylsulfanylbenzoate Openeye Name: [2-(4-bromoanilino)-2-oxo-ethyl] 2-methylsulfanylbenzoate CAS Name: 2-(methylthio)benzoic acid [2-(4-bromoanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromoanilino)-2-oxoethyl] 2-methylsulfanylbenzoate Traditional Name: 2-(methylthio)benzoic acid [2-(4-bromoanilino)-2-keto-ethyl] ester Formula: C16H14BrNO3S MolecularWeight: 380.25626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C(=O)OCC(=O)NC2=CC=C(C=C2)Br

Isomeric SMILES

CSC1=CC=CC=C1C(=O)OCC(=O)NC2=CC=C(C=C2)Br

InChI

InChI=1S/C16H14BrNO3S/c1-22-14-5-3-2-4-13(14)16(20)21-10-15(19)18-12-8-6-11(17)7-9-12/h2-9H,10H2,1H3,(H,18,19)