(2R)-2-[[[(4-bromophenyl)sulfonylamino]-phenyl-methylidene]amino]-4-methylsulfanyl-butanoic acid

Systemtic Name: (2R)-2-[[[(4-bromophenyl)sulfonylamino]-phenyl-methylidene]amino]-4-methylsulfanyl-butanoic acid Openeye Name: (2R)-2-[[[(4-bromophenyl)sulfonylamino]-phenyl-methylene]amino]-4-methylsulfanyl-butanoic acid CAS Name: (2R)-2-[[[(4-bromophenyl)sulfonylamino]-phenylmethylidene]amino]-4-(methylthio)butanoic acid IUPAC Name: (2R)-2-[[[(4-bromophenyl)sulfonylamino]-phenylmethylidene]amino]-4-methylsulfanylbutanoic acid Traditional Name: (2R)-2-[[(brosylamino)-phenyl-methylene]amino]-4-(methylthio)butyric acid Formula: C18H19BrN2O4S2 MolecularWeight: 471.38846

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)N=C(C1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CSCC[C@H](C(=O)O)N=C(C1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C18H19BrN2O4S2/c1-26-12-11-16(18(22)23)20-17(13-5-3-2-4-6-13)21-27(24,25)15-9-7-14(19)8-10-15/h2-10,16H,11-12H2,1H3,(H,20,21)(H,22,23)/t16-/m1/s1