5-[[2-chloranyl-6-(4-chlorophenyl)sulfanyl-phenyl]methylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[[2-chloranyl-6-(4-chlorophenyl)sulfanyl-phenyl]methylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[[2-chloro-6-(4-chlorophenyl)sulfanyl-phenyl]methylamino]-5-oxo-pentanoic acid CAS Name: 5-[[2-chloro-6-[(4-chlorophenyl)thio]phenyl]methylamino]-5-oxopentanoic acid IUPAC Name: 5-[[2-chloro-6-(4-chlorophenyl)sulfanylphenyl]methylamino]-5-oxopentanoic acid Traditional Name: 5-[[2-chloro-6-[(4-chlorophenyl)thio]benzyl]amino]-5-keto-valeric acid Formula: C18H17Cl2NO3S MolecularWeight: 398.30348

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17Cl2NO3S/c19-12-7-9-13(10-8-12)25-16-4-1-3-15(20)14(16)11-21-17(22)5-2-6-18(23)24/h1,3-4,7-10H,2,5-6,11H2,(H,21,22)(H,23,24)