2-[cyclopentyl-(3-methyl-2-sulfanyl-phenyl)carbonyl-amino]ethanoic acid

Systemtic Name: 2-[cyclopentyl-(3-methyl-2-sulfanyl-phenyl)carbonyl-amino]ethanoic acid Openeye Name: 2-[cyclopentyl-(3-methyl-2-sulfanyl-benzoyl)amino]acetic acid CAS Name: 2-[cyclopentyl-[(2-mercapto-3-methylphenyl)-oxomethyl]amino]acetic acid IUPAC Name: 2-[cyclopentyl-(3-methyl-2-sulfanylbenzoyl)amino]acetic acid Traditional Name: 2-[cyclopentyl-(2-mercapto-3-methyl-benzoyl)amino]acetic acid Formula: C15H19NO3S MolecularWeight: 293.38126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1S)C(=O)N(CC(=O)O)C2CCCC2

Isomeric SMILES

CC1=CC=CC(=C1S)C(=O)N(CC(=O)O)C2CCCC2

InChI

InChI=1S/C15H19NO3S/c1-10-5-4-8-12(14(10)20)15(19)16(9-13(17)18)11-6-2-3-7-11/h4-5,8,11,20H,2-3,6-7,9H2,1H3,(H,17,18)