4-[[2-chloranyl-6-(4-chlorophenyl)sulfanyl-phenyl]methylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[2-chloranyl-6-(4-chlorophenyl)sulfanyl-phenyl]methylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[2-chloro-6-(4-chlorophenyl)sulfanyl-phenyl]methylamino]-4-oxo-butanoic acid CAS Name: 4-[[2-chloro-6-[(4-chlorophenyl)thio]phenyl]methylamino]-4-oxobutanoic acid IUPAC Name: 4-[[2-chloro-6-(4-chlorophenyl)sulfanylphenyl]methylamino]-4-oxobutanoic acid Traditional Name: 4-[[2-chloro-6-[(4-chlorophenyl)thio]benzyl]amino]-4-keto-butyric acid Formula: C17H15Cl2NO3S MolecularWeight: 384.2769

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)CNC(=O)CCC(=O)O)SC2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CNC(=O)CCC(=O)O)SC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H15Cl2NO3S/c18-11-4-6-12(7-5-11)24-15-3-1-2-14(19)13(15)10-20-16(21)8-9-17(22)23/h1-7H,8-10H2,(H,20,21)(H,22,23)