2-(cyclopentylamino)-4-methyl-3-oxidanylidene-2-(phenylcarbonylsulfanyl)pentanoic acid

Systemtic Name: 2-(cyclopentylamino)-4-methyl-3-oxidanylidene-2-(phenylcarbonylsulfanyl)pentanoic acid Openeye Name: 2-benzoylsulfanyl-2-(cyclopentylamino)-4-methyl-3-oxo-pentanoic acid CAS Name: 2-(benzoylthio)-2-(cyclopentylamino)-4-methyl-3-oxopentanoic acid IUPAC Name: 2-benzoylsulfanyl-2-(cyclopentylamino)-4-methyl-3-oxopentanoic acid Traditional Name: 2-(benzoylthio)-2-(cyclopentylamino)-3-keto-4-methyl-valeric acid Formula: C18H23NO4S MolecularWeight: 349.44452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C(C(=O)O)(NC1CCCC1)SC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)C(=O)C(C(=O)O)(NC1CCCC1)SC(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H23NO4S/c1-12(2)15(20)18(17(22)23,19-14-10-6-7-11-14)24-16(21)13-8-4-3-5-9-13/h3-5,8-9,12,14,19H,6-7,10-11H2,1-2H3,(H,22,23)