5-(4-chlorophenyl)-2-(phenylcarbamoylsulfanyl)pentanoic acid

Systemtic Name: 5-(4-chlorophenyl)-2-(phenylcarbamoylsulfanyl)pentanoic acid Openeye Name: 5-(4-chlorophenyl)-2-(phenylcarbamoylsulfanyl)pentanoic acid CAS Name: 2-[[anilino(oxo)methyl]thio]-5-(4-chlorophenyl)pentanoic acid IUPAC Name: 5-(4-chlorophenyl)-2-(phenylcarbamoylsulfanyl)pentanoic acid Traditional Name: 5-(4-chlorophenyl)-2-(phenylcarbamoylthio)valeric acid Formula: C18H18ClNO3S MolecularWeight: 363.85842

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)SC(CCCC2=CC=C(C=C2)Cl)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)SC(CCCC2=CC=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C18H18ClNO3S/c19-14-11-9-13(10-12-14)5-4-8-16(17(21)22)24-18(23)20-15-6-2-1-3-7-15/h1-3,6-7,9-12,16H,4-5,8H2,(H,20,23)(H,21,22)