N-(3-methylbutyl)-2-phenylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-(3-methylbutyl)-2-phenylsulfanyl-pyridine-3-carboxamide Openeye Name: N-isopentyl-2-phenylsulfanyl-pyridine-3-carboxamide CAS Name: N-(3-methylbutyl)-2-(phenylthio)-3-pyridinecarboxamide IUPAC Name: N-(3-methylbutyl)-2-phenylsulfanylpyridine-3-carboxamide Traditional Name: N-isoamyl-2-(phenylthio)nicotinamide Formula: C17H20N2OS MolecularWeight: 300.4185

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N2OS/c1-13(2)10-12-18-16(20)15-9-6-11-19-17(15)21-14-7-4-3-5-8-14/h3-9,11,13H,10,12H2,1-2H3,(H,18,20)