3-cyano-6-cyclopropyl-N-[(4-methylphenyl)methyl]-2-methylsulfanyl-pyridine-4-carboxamide

Systemtic Name: 3-cyano-6-cyclopropyl-N-[(4-methylphenyl)methyl]-2-methylsulfanyl-pyridine-4-carboxamide Openeye Name: 3-cyano-6-cyclopropyl-2-methylsulfanyl-N-(p-tolylmethyl)pyridine-4-carboxamide CAS Name: 3-cyano-6-cyclopropyl-N-[(4-methylphenyl)methyl]-2-(methylthio)-4-pyridinecarboxamide IUPAC Name: 3-cyano-6-cyclopropyl-N-[(4-methylphenyl)methyl]-2-methylsulfanylpyridine-4-carboxamide Traditional Name: 3-cyano-6-cyclopropyl-N-(4-methylbenzyl)-2-(methylthio)isonicotinamide Formula: C19H19N3OS MolecularWeight: 337.43866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2=CC(=NC(=C2C#N)SC)C3CC3

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2=CC(=NC(=C2C#N)SC)C3CC3

InChI

InChI=1S/C19H19N3OS/c1-12-3-5-13(6-4-12)11-21-18(23)15-9-17(14-7-8-14)22-19(24-2)16(15)10-20/h3-6,9,14H,7-8,11H2,1-2H3,(H,21,23)