N-[[(1S,2S)-2-oxidanylcyclopentyl]methyl]-N-(phenylmethyl)-2-(phenylmethylsulfanyl)pyridine-3-carboxamide

Systemtic Name: N-[[(1S,2S)-2-oxidanylcyclopentyl]methyl]-N-(phenylmethyl)-2-(phenylmethylsulfanyl)pyridine-3-carboxamide Openeye Name: N-benzyl-2-benzylsulfanyl-N-[[(1S,2S)-2-hydroxycyclopentyl]methyl]pyridine-3-carboxamide CAS Name: N-[[(1S,2S)-2-hydroxycyclopentyl]methyl]-N-(phenylmethyl)-2-(phenylmethylthio)-3-pyridinecarboxamide IUPAC Name: N-benzyl-2-benzylsulfanyl-N-[[(1S,2S)-2-hydroxycyclopentyl]methyl]pyridine-3-carboxamide Traditional Name: N-benzyl-2-(benzylthio)-N-[[(1S,2S)-2-hydroxycyclopentyl]methyl]nicotinamide Formula: C26H28N2O2S MolecularWeight: 432.57772

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(C1)O)CN(CC2=CC=CC=C2)C(=O)C3=C(N=CC=C3)SCC4=CC=CC=C4

Isomeric SMILES

C1C[C@H]([C@H](C1)O)CN(CC2=CC=CC=C2)C(=O)C3=C(N=CC=C3)SCC4=CC=CC=C4

InChI

InChI=1S/C26H28N2O2S/c29-24-15-7-13-22(24)18-28(17-20-9-3-1-4-10-20)26(30)23-14-8-16-27-25(23)31-19-21-11-5-2-6-12-21/h1-6,8-12,14,16,22,24,29H,7,13,15,17-19H2/t22-,24-/m0/s1