[1-oxidanylidene-1-(1-phenylethylamino)propan-2-yl] 2-(4-bromophenyl)sulfanylethanoate

Systemtic Name: [1-oxidanylidene-1-(1-phenylethylamino)propan-2-yl] 2-(4-bromophenyl)sulfanylethanoate Openeye Name: [1-methyl-2-oxo-2-(1-phenylethylamino)ethyl] 2-(4-bromophenyl)sulfanylacetate CAS Name: 2-[(4-bromophenyl)thio]acetic acid [1-oxo-1-(1-phenylethylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(1-phenylethylamino)propan-2-yl] 2-(4-bromophenyl)sulfanylacetate Traditional Name: 2-[(4-bromophenyl)thio]acetic acid [2-keto-1-methyl-2-(1-phenylethylamino)ethyl] ester Formula: C19H20BrNO3S MolecularWeight: 422.336

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C(C)OC(=O)CSC2=CC=C(C=C2)Br

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)C(C)OC(=O)CSC2=CC=C(C=C2)Br

InChI

InChI=1S/C19H20BrNO3S/c1-13(15-6-4-3-5-7-15)21-19(23)14(2)24-18(22)12-25-17-10-8-16(20)9-11-17/h3-11,13-14H,12H2,1-2H3,(H,21,23)