N-(2-oxidanylpropyl)-2-(phenylmethylsulfanyl)pyridine-3-carboxamide

Systemtic Name: N-(2-oxidanylpropyl)-2-(phenylmethylsulfanyl)pyridine-3-carboxamide Openeye Name: 2-benzylsulfanyl-N-(2-hydroxypropyl)pyridine-3-carboxamide CAS Name: N-(2-hydroxypropyl)-2-(phenylmethylthio)-3-pyridinecarboxamide IUPAC Name: 2-benzylsulfanyl-N-(2-hydroxypropyl)pyridine-3-carboxamide Traditional Name: 2-(benzylthio)-N-(2-hydroxypropyl)nicotinamide Formula: C16H18N2O2S MolecularWeight: 302.39132

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C1=C(N=CC=C1)SCC2=CC=CC=C2)O

Isomeric SMILES

CC(CNC(=O)C1=C(N=CC=C1)SCC2=CC=CC=C2)O

InChI

InChI=1S/C16H18N2O2S/c1-12(19)10-18-15(20)14-8-5-9-17-16(14)21-11-13-6-3-2-4-7-13/h2-9,12,19H,10-11H2,1H3,(H,18,20)