N-butyl-2-phenylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-butyl-2-phenylsulfanyl-pyridine-3-carboxamide Openeye Name: N-butyl-2-phenylsulfanyl-pyridine-3-carboxamide CAS Name: N-butyl-2-(phenylthio)-3-pyridinecarboxamide IUPAC Name: N-butyl-2-phenylsulfanylpyridine-3-carboxamide Traditional Name: N-butyl-2-(phenylthio)nicotinamide Formula: C16H18N2OS MolecularWeight: 286.39192

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=C(N=CC=C1)SC2=CC=CC=C2

Isomeric SMILES

CCCCNC(=O)C1=C(N=CC=C1)SC2=CC=CC=C2

InChI

InChI=1S/C16H18N2OS/c1-2-3-11-17-15(19)14-10-7-12-18-16(14)20-13-8-5-4-6-9-13/h4-10,12H,2-3,11H2,1H3,(H,17,19)