2-[(1R)-2-[(4-bromophenyl)amino]-1-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: 2-[(1R)-2-[(4-bromophenyl)amino]-1-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: 2-[(1R)-2-(4-bromoanilino)-1-(4-chlorophenyl)-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[(1R)-2-(4-bromoanilino)-1-(4-chlorophenyl)-2-oxoethyl]thio]acetate IUPAC Name: 2-[(1R)-2-(4-bromoanilino)-1-(4-chlorophenyl)-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[(1R)-2-(4-bromoanilino)-1-(4-chlorophenyl)-2-keto-ethyl]thio]acetate Formula: C16H12BrClNO3S- MolecularWeight: 413.69338

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(C(=O)NC2=CC=C(C=C2)Br)SCC(=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1[C@H](C(=O)NC2=CC=C(C=C2)Br)SCC(=O)[O-])Cl

InChI

InChI=1S/C16H13BrClNO3S/c17-11-3-7-13(8-4-11)19-16(22)15(23-9-14(20)21)10-1-5-12(18)6-2-10/h1-8,15H,9H2,(H,19,22)(H,20,21)/p-1/t15-/m1/s1