3-cyano-6-cyclopropyl-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]-2-methylsulfanyl-pyridine-4-carboxamide

Systemtic Name: 3-cyano-6-cyclopropyl-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]-2-methylsulfanyl-pyridine-4-carboxamide Openeye Name: 3-cyano-6-cyclopropyl-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]-2-methylsulfanyl-pyridine-4-carboxamide CAS Name: 3-cyano-6-cyclopropyl-N-[2-methyl-4-(4-methyl-1-piperazinyl)phenyl]-2-(methylthio)-4-pyridinecarboxamide IUPAC Name: 3-cyano-6-cyclopropyl-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]-2-methylsulfanylpyridine-4-carboxamide Traditional Name: 3-cyano-6-cyclopropyl-N-[2-methyl-4-(4-methylpiperazino)phenyl]-2-(methylthio)isonicotinamide Formula: C23H27N5OS MolecularWeight: 421.55838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CCN(CC2)C)NC(=O)C3=CC(=NC(=C3C#N)SC)C4CC4

Isomeric SMILES

CC1=C(C=CC(=C1)N2CCN(CC2)C)NC(=O)C3=CC(=NC(=C3C#N)SC)C4CC4

InChI

InChI=1S/C23H27N5OS/c1-15-12-17(28-10-8-27(2)9-11-28)6-7-20(15)25-22(29)18-13-21(16-4-5-16)26-23(30-3)19(18)14-24/h6-7,12-13,16H,4-5,8-11H2,1-3H3,(H,25,29)