N-[3-(1-hydroxyethyl)phenyl]-2-(phenylmethylsulfanyl)pyridine-3-carboxamide

Systemtic Name: N-[3-(1-hydroxyethyl)phenyl]-2-(phenylmethylsulfanyl)pyridine-3-carboxamide Openeye Name: 2-benzylsulfanyl-N-[3-(1-hydroxyethyl)phenyl]pyridine-3-carboxamide CAS Name: N-[3-(1-hydroxyethyl)phenyl]-2-(phenylmethylthio)-3-pyridinecarboxamide IUPAC Name: 2-benzylsulfanyl-N-[3-(1-hydroxyethyl)phenyl]pyridine-3-carboxamide Traditional Name: 2-(benzylthio)-N-[3-(1-hydroxyethyl)phenyl]nicotinamide Formula: C21H20N2O2S MolecularWeight: 364.4607

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20N2O2S/c1-15(24)17-9-5-10-18(13-17)23-20(25)19-11-6-12-22-21(19)26-14-16-7-3-2-4-8-16/h2-13,15,24H,14H2,1H3,(H,23,25)