3-cyano-6-cyclopropyl-N-[3-[[ethanoyl(ethyl)amino]methyl]phenyl]-2-methylsulfanyl-pyridine-4-carboxamide

Systemtic Name: 3-cyano-6-cyclopropyl-N-[3-[[ethanoyl(ethyl)amino]methyl]phenyl]-2-methylsulfanyl-pyridine-4-carboxamide Openeye Name: N-[3-[[acetyl(ethyl)amino]methyl]phenyl]-3-cyano-6-cyclopropyl-2-methylsulfanyl-pyridine-4-carboxamide CAS Name: N-[3-[[acetyl(ethyl)amino]methyl]phenyl]-3-cyano-6-cyclopropyl-2-(methylthio)-4-pyridinecarboxamide IUPAC Name: N-[3-[[acetyl(ethyl)amino]methyl]phenyl]-3-cyano-6-cyclopropyl-2-methylsulfanylpyridine-4-carboxamide Traditional Name: N-[3-[[acetyl(ethyl)amino]methyl]phenyl]-3-cyano-6-cyclopropyl-2-(methylthio)isonicotinamide Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N4O2S/c1-4-26(14(2)27)13-15-6-5-7-17(10-15)24-21(28)18-11-20(16-8-9-16)25-22(29-3)19(18)12-23/h5-7,10-11,16H,4,8-9,13H2,1-3H3,(H,24,28)