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

Systemtic Name: 2-carbamimidoylsulfanyl-4-[4-(2-chlorophenyl)phenyl]butanoic acid Openeye Name: 2-carbamimidoylsulfanyl-4-[4-(2-chlorophenyl)phenyl]butanoic acid CAS Name: 2-(carbamimidoylthio)-4-[4-(2-chlorophenyl)phenyl]butanoic acid IUPAC Name: 2-carbamimidoylsulfanyl-4-[4-(2-chlorophenyl)phenyl]butanoic acid Traditional Name: 2-(amidinothio)-4-[4-(2-chlorophenyl)phenyl]butyric acid Formula: C17H17ClN2O2S MolecularWeight: 348.84708

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17ClN2O2S/c18-14-4-2-1-3-13(14)12-8-5-11(6-9-12)7-10-15(16(21)22)23-17(19)20/h1-6,8-9,15H,7,10H2,(H3,19,20)(H,21,22)