2-[cyclopentyl-(2-ethanoylsulfanyl-3-propan-2-yl-phenyl)carbonyl-amino]ethanoic acid

Systemtic Name: 2-[cyclopentyl-(2-ethanoylsulfanyl-3-propan-2-yl-phenyl)carbonyl-amino]ethanoic acid Openeye Name: 2-[(2-acetylsulfanyl-3-isopropyl-benzoyl)-cyclopentyl-amino]acetic acid CAS Name: 2-[[[2-(acetylthio)-3-propan-2-ylphenyl]-oxomethyl]-cyclopentylamino]acetic acid IUPAC Name: 2-[(2-acetylsulfanyl-3-propan-2-ylbenzoyl)-cyclopentylamino]acetic acid Traditional Name: 2-[[2-(acetylthio)-3-isopropyl-benzoyl]-cyclopentyl-amino]acetic acid Formula: C19H25NO4S MolecularWeight: 363.4711

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC(=C1SC(=O)C)C(=O)N(CC(=O)O)C2CCCC2

Isomeric SMILES

CC(C)C1=CC=CC(=C1SC(=O)C)C(=O)N(CC(=O)O)C2CCCC2

InChI

InChI=1S/C19H25NO4S/c1-12(2)15-9-6-10-16(18(15)25-13(3)21)19(24)20(11-17(22)23)14-7-4-5-8-14/h6,9-10,12,14H,4-5,7-8,11H2,1-3H3,(H,22,23)