(2S)-2-[[[(4-bromophenyl)sulfonylamino]-phenyl-methylidene]amino]-4-methylsulfanyl-butanoate

Systemtic Name: (2S)-2-[[[(4-bromophenyl)sulfonylamino]-phenyl-methylidene]amino]-4-methylsulfanyl-butanoate Openeye Name: (2S)-2-[[[(4-bromophenyl)sulfonylamino]-phenyl-methylene]amino]-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[[(4-bromophenyl)sulfonylamino]-phenylmethylidene]amino]-4-(methylthio)butanoate IUPAC Name: (2S)-2-[[[(4-bromophenyl)sulfonylamino]-phenylmethylidene]amino]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[[(brosylamino)-phenyl-methylene]amino]-4-(methylthio)butyrate Formula: C18H18BrN2O4S2- MolecularWeight: 470.38052

Click to see the large picture

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)/p-1/t16-/m0/s1