5-phenyl-2-[[1-(phenylcarbonyl)piperidin-4-yl]sulfanylmethyl]pentanoic acid

Systemtic Name: 5-phenyl-2-[[1-(phenylcarbonyl)piperidin-4-yl]sulfanylmethyl]pentanoic acid Openeye Name: 2-[(1-benzoyl-4-piperidyl)sulfanylmethyl]-5-phenyl-pentanoic acid CAS Name: 2-[[(1-benzoyl-4-piperidinyl)thio]methyl]-5-phenylpentanoic acid IUPAC Name: 2-[(1-benzoylpiperidin-4-yl)sulfanylmethyl]-5-phenylpentanoic acid Traditional Name: 2-[[(1-benzoyl-4-piperidyl)thio]methyl]-5-phenyl-valeric acid Formula: C24H29NO3S MolecularWeight: 411.55696

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1SCC(CCCC2=CC=CC=C2)C(=O)O)C(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1SCC(CCCC2=CC=CC=C2)C(=O)O)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C24H29NO3S/c26-23(20-11-5-2-6-12-20)25-16-14-22(15-17-25)29-18-21(24(27)28)13-7-10-19-8-3-1-4-9-19/h1-6,8-9,11-12,21-22H,7,10,13-18H2,(H,27,28)