2-[2-(2-chlorophenyl)sulfanylethanoylamino]pentanoic acid

Systemtic Name: 2-[2-(2-chlorophenyl)sulfanylethanoylamino]pentanoic acid Openeye Name: 2-[[2-(2-chlorophenyl)sulfanylacetyl]amino]pentanoic acid CAS Name: 2-[[2-[(2-chlorophenyl)thio]-1-oxoethyl]amino]pentanoic acid IUPAC Name: 2-[[2-(2-chlorophenyl)sulfanylacetyl]amino]pentanoic acid Traditional Name: 2-[[2-[(2-chlorophenyl)thio]acetyl]amino]valeric acid Formula: C13H16ClNO3S MolecularWeight: 301.78904

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)O)NC(=O)CSC1=CC=CC=C1Cl

Isomeric SMILES

CCCC(C(=O)O)NC(=O)CSC1=CC=CC=C1Cl

InChI

InChI=1S/C13H16ClNO3S/c1-2-5-10(13(17)18)15-12(16)8-19-11-7-4-3-6-9(11)14/h3-4,6-7,10H,2,5,8H2,1H3,(H,15,16)(H,17,18)