2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanyl-N-[(1-phenylpyrazol-4-yl)methyl]ethanamide

Systemtic Name: 2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanyl-N-[(1-phenylpyrazol-4-yl)methyl]ethanamide Openeye Name: 2-[(3-cyano-4,6-dimethyl-2-pyridyl)sulfanyl]-N-[(1-phenylpyrazol-4-yl)methyl]acetamide CAS Name: 2-[(3-cyano-4,6-dimethyl-2-pyridinyl)thio]-N-[(1-phenyl-4-pyrazolyl)methyl]acetamide IUPAC Name: 2-(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl-N-[(1-phenylpyrazol-4-yl)methyl]acetamide Traditional Name: 2-[(3-cyano-4,6-dimethyl-2-pyridyl)thio]-N-[(1-phenylpyrazol-4-yl)methyl]acetamide Formula: C20H19N5OS MolecularWeight: 377.46276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SCC(=O)NCC2=CN(N=C2)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SCC(=O)NCC2=CN(N=C2)C3=CC=CC=C3)C

InChI

InChI=1S/C20H19N5OS/c1-14-8-15(2)24-20(18(14)9-21)27-13-19(26)22-10-16-11-23-25(12-16)17-6-4-3-5-7-17/h3-8,11-12H,10,13H2,1-2H3,(H,22,26)