2-carbamimidoylsulfanyl-2-[4-(4-chlorophenyl)phenyl]ethanoic acid

Systemtic Name: 2-carbamimidoylsulfanyl-2-[4-(4-chlorophenyl)phenyl]ethanoic acid Openeye Name: 2-carbamimidoylsulfanyl-2-[4-(4-chlorophenyl)phenyl]acetic acid CAS Name: 2-(carbamimidoylthio)-2-[4-(4-chlorophenyl)phenyl]acetic acid IUPAC Name: 2-carbamimidoylsulfanyl-2-[4-(4-chlorophenyl)phenyl]acetic acid Traditional Name: 2-(amidinothio)-2-[4-(4-chlorophenyl)phenyl]acetic acid Formula: C15H13ClN2O2S MolecularWeight: 320.79392

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC=C(C=C2)Cl)C(C(=O)O)SC(=N)N

Isomeric SMILES

C1=CC(=CC=C1C2=CC=C(C=C2)Cl)C(C(=O)O)SC(=N)N

InChI

InChI=1S/C15H13ClN2O2S/c16-12-7-5-10(6-8-12)9-1-3-11(4-2-9)13(14(19)20)21-15(17)18/h1-8,13H,(H3,17,18)(H,19,20)