6-methyl-2-[1-[2-(phenylmethylsulfanyl)ethanoyl]piperidin-4-yl]-N-(2-propoxyethyl)pyridine-3-carboxamide

Systemtic Name: 6-methyl-2-[1-[2-(phenylmethylsulfanyl)ethanoyl]piperidin-4-yl]-N-(2-propoxyethyl)pyridine-3-carboxamide Openeye Name: 2-[1-(2-benzylsulfanylacetyl)-4-piperidyl]-6-methyl-N-(2-propoxyethyl)pyridine-3-carboxamide CAS Name: 6-methyl-2-[1-[1-oxo-2-(phenylmethylthio)ethyl]-4-piperidinyl]-N-(2-propoxyethyl)-3-pyridinecarboxamide IUPAC Name: 2-[1-(2-benzylsulfanylacetyl)piperidin-4-yl]-6-methyl-N-(2-propoxyethyl)pyridine-3-carboxamide Traditional Name: 2-[1-[2-(benzylthio)acetyl]-4-piperidyl]-6-methyl-N-(2-propoxyethyl)nicotinamide Formula: C26H35N3O3S MolecularWeight: 469.6394

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Descriptors Computed from Structure

Canonical SMILES:

CCCOCCNC(=O)C1=C(N=C(C=C1)C)C2CCN(CC2)C(=O)CSCC3=CC=CC=C3

Isomeric SMILES

CCCOCCNC(=O)C1=C(N=C(C=C1)C)C2CCN(CC2)C(=O)CSCC3=CC=CC=C3

InChI

InChI=1S/C26H35N3O3S/c1-3-16-32-17-13-27-26(31)23-10-9-20(2)28-25(23)22-11-14-29(15-12-22)24(30)19-33-18-21-7-5-4-6-8-21/h4-10,22H,3,11-19H2,1-2H3,(H,27,31)