N-[(1R,2R)-2-phenylmethoxycyclohexyl]-2-(phenylmethylsulfanyl)pyridine-3-carboxamide

Systemtic Name: N-[(1R,2R)-2-phenylmethoxycyclohexyl]-2-(phenylmethylsulfanyl)pyridine-3-carboxamide Openeye Name: N-[(1R,2R)-2-benzyloxycyclohexyl]-2-benzylsulfanyl-pyridine-3-carboxamide CAS Name: N-[(1R,2R)-2-phenylmethoxycyclohexyl]-2-(phenylmethylthio)-3-pyridinecarboxamide IUPAC Name: 2-benzylsulfanyl-N-[(1R,2R)-2-phenylmethoxycyclohexyl]pyridine-3-carboxamide Traditional Name: N-[(1R,2R)-2-benzoxycyclohexyl]-2-(benzylthio)nicotinamide Formula: C26H28N2O2S MolecularWeight: 432.57772

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)NC(=O)C2=C(N=CC=C2)SCC3=CC=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

C1CC[C@H]([C@@H](C1)NC(=O)C2=C(N=CC=C2)SCC3=CC=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C26H28N2O2S/c29-25(22-14-9-17-27-26(22)31-19-21-12-5-2-6-13-21)28-23-15-7-8-16-24(23)30-18-20-10-3-1-4-11-20/h1-6,9-14,17,23-24H,7-8,15-16,18-19H2,(H,28,29)/t23-,24-/m1/s1