2-(3-cyano-4,5,6-trimethyl-pyridin-2-yl)sulfanyl-N-(5-methyl-2-phenyl-pyrazol-3-yl)ethanamide

Systemtic Name: 2-(3-cyano-4,5,6-trimethyl-pyridin-2-yl)sulfanyl-N-(5-methyl-2-phenyl-pyrazol-3-yl)ethanamide Openeye Name: 2-[(3-cyano-4,5,6-trimethyl-2-pyridyl)sulfanyl]-N-(5-methyl-2-phenyl-pyrazol-3-yl)acetamide CAS Name: 2-[(3-cyano-4,5,6-trimethyl-2-pyridinyl)thio]-N-(5-methyl-2-phenyl-3-pyrazolyl)acetamide IUPAC Name: 2-(3-cyano-4,5,6-trimethylpyridin-2-yl)sulfanyl-N-(5-methyl-2-phenylpyrazol-3-yl)acetamide Traditional Name: 2-[(3-cyano-4,5,6-trimethyl-2-pyridyl)thio]-N-(5-methyl-2-phenyl-pyrazol-3-yl)acetamide Formula: C21H21N5OS MolecularWeight: 391.48934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)CSC2=NC(=C(C(=C2C#N)C)C)C)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)CSC2=NC(=C(C(=C2C#N)C)C)C)C3=CC=CC=C3

InChI

InChI=1S/C21H21N5OS/c1-13-10-19(26(25-13)17-8-6-5-7-9-17)24-20(27)12-28-21-18(11-22)15(3)14(2)16(4)23-21/h5-10H,12H2,1-4H3,(H,24,27)