1-[2-(phenylcarbonylsulfanyl)-3,3-dipropyl-cyclopentyl]carbonylpyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-(phenylcarbonylsulfanyl)-3,3-dipropyl-cyclopentyl]carbonylpyrrolidine-2-carboxylic acid Openeye Name: 1-(2-benzoylsulfanyl-3,3-dipropyl-cyclopentanecarbonyl)pyrrolidine-2-carboxylic acid CAS Name: 1-[[2-(benzoylthio)-3,3-dipropylcyclopentyl]-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(2-benzoylsulfanyl-3,3-dipropylcyclopentanecarbonyl)pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-(benzoylthio)-3,3-dipropyl-cyclopentanecarbonyl]proline Formula: C24H33NO4S MolecularWeight: 431.58812

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CCC(C1SC(=O)C2=CC=CC=C2)C(=O)N3CCCC3C(=O)O)CCC

Isomeric SMILES

CCCC1(CCC(C1SC(=O)C2=CC=CC=C2)C(=O)N3CCCC3C(=O)O)CCC

InChI

InChI=1S/C24H33NO4S/c1-3-13-24(14-4-2)15-12-18(21(26)25-16-8-11-19(25)22(27)28)20(24)30-23(29)17-9-6-5-7-10-17/h5-7,9-10,18-20H,3-4,8,11-16H2,1-2H3,(H,27,28)