N-(2-methyl-1-oxidanyl-propan-2-yl)-2-(phenylmethylsulfanyl)pyridine-3-carboxamide

Systemtic Name: N-(2-methyl-1-oxidanyl-propan-2-yl)-2-(phenylmethylsulfanyl)pyridine-3-carboxamide Openeye Name: 2-benzylsulfanyl-N-(2-hydroxy-1,1-dimethyl-ethyl)pyridine-3-carboxamide CAS Name: N-(1-hydroxy-2-methylpropan-2-yl)-2-(phenylmethylthio)-3-pyridinecarboxamide IUPAC Name: 2-benzylsulfanyl-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-3-carboxamide Traditional Name: 2-(benzylthio)-N-(2-hydroxy-1,1-dimethyl-ethyl)nicotinamide Formula: C17H20N2O2S MolecularWeight: 316.4179

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CO)NC(=O)C1=C(N=CC=C1)SCC2=CC=CC=C2

Isomeric SMILES

CC(C)(CO)NC(=O)C1=C(N=CC=C1)SCC2=CC=CC=C2

InChI

InChI=1S/C17H20N2O2S/c1-17(2,12-20)19-15(21)14-9-6-10-18-16(14)22-11-13-7-4-3-5-8-13/h3-10,20H,11-12H2,1-2H3,(H,19,21)