2-[(3-chloranyl-2-sulfanyl-phenyl)carbonyl-cyclopentyl-amino]butanoic acid

Systemtic Name: 2-[(3-chloranyl-2-sulfanyl-phenyl)carbonyl-cyclopentyl-amino]butanoic acid Openeye Name: 2-[(3-chloro-2-sulfanyl-benzoyl)-cyclopentyl-amino]butanoic acid CAS Name: 2-[[(3-chloro-2-mercaptophenyl)-oxomethyl]-cyclopentylamino]butanoic acid IUPAC Name: 2-[(3-chloro-2-sulfanylbenzoyl)-cyclopentylamino]butanoic acid Traditional Name: 2-[(3-chloro-2-mercapto-benzoyl)-cyclopentyl-amino]butyric acid Formula: C16H20ClNO3S MolecularWeight: 341.8529

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)N(C1CCCC1)C(=O)C2=C(C(=CC=C2)Cl)S

Isomeric SMILES

CCC(C(=O)O)N(C1CCCC1)C(=O)C2=C(C(=CC=C2)Cl)S

InChI

InChI=1S/C16H20ClNO3S/c1-2-13(16(20)21)18(10-6-3-4-7-10)15(19)11-8-5-9-12(17)14(11)22/h5,8-10,13,22H,2-4,6-7H2,1H3,(H,20,21)