[(1S)-2-(dimethylamino)-2-oxidanylidene-1-phenyl-ethyl] 2-(4-bromophenyl)sulfanylethanoate

Systemtic Name: [(1S)-2-(dimethylamino)-2-oxidanylidene-1-phenyl-ethyl] 2-(4-bromophenyl)sulfanylethanoate Openeye Name: [(1S)-2-(dimethylamino)-2-oxo-1-phenyl-ethyl] 2-(4-bromophenyl)sulfanylacetate CAS Name: 2-[(4-bromophenyl)thio]acetic acid [(1S)-2-(dimethylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1S)-2-(dimethylamino)-2-oxo-1-phenylethyl] 2-(4-bromophenyl)sulfanylacetate Traditional Name: 2-[(4-bromophenyl)thio]acetic acid [(1S)-2-(dimethylamino)-2-keto-1-phenyl-ethyl] ester Formula: C18H18BrNO3S MolecularWeight: 408.30942

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CN(C)C(=O)[C@H](C1=CC=CC=C1)OC(=O)CSC2=CC=C(C=C2)Br

InChI

InChI=1S/C18H18BrNO3S/c1-20(2)18(22)17(13-6-4-3-5-7-13)23-16(21)12-24-15-10-8-14(19)9-11-15/h3-11,17H,12H2,1-2H3/t17-/m0/s1