2-[[2-chloranyl-6-(4-chlorophenyl)sulfanyl-phenyl]methylcarbamoyl]benzoic acid

Systemtic Name: 2-[[2-chloranyl-6-(4-chlorophenyl)sulfanyl-phenyl]methylcarbamoyl]benzoic acid Openeye Name: 2-[[2-chloro-6-(4-chlorophenyl)sulfanyl-phenyl]methylcarbamoyl]benzoic acid CAS Name: 2-[[[2-chloro-6-[(4-chlorophenyl)thio]phenyl]methylamino]-oxomethyl]benzoic acid IUPAC Name: 2-[[2-chloro-6-(4-chlorophenyl)sulfanylphenyl]methylcarbamoyl]benzoic acid Traditional Name: 2-[[2-chloro-6-[(4-chlorophenyl)thio]benzyl]carbamoyl]benzoic acid Formula: C21H15Cl2NO3S MolecularWeight: 432.3197

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NCC2=C(C=CC=C2Cl)SC3=CC=C(C=C3)Cl)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NCC2=C(C=CC=C2Cl)SC3=CC=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C21H15Cl2NO3S/c22-13-8-10-14(11-9-13)28-19-7-3-6-18(23)17(19)12-24-20(25)15-4-1-2-5-16(15)21(26)27/h1-11H,12H2,(H,24,25)(H,26,27)