1-(2-cyanoethyl)-3-(3,4-dimethylphenyl)-N-(1,3-thiazol-2-yl)pyrazole-4-carboxamide

Systemtic Name: 1-(2-cyanoethyl)-3-(3,4-dimethylphenyl)-N-(1,3-thiazol-2-yl)pyrazole-4-carboxamide Openeye Name: 1-(2-cyanoethyl)-3-(3,4-dimethylphenyl)-N-thiazol-2-yl-pyrazole-4-carboxamide CAS Name: 1-(2-cyanoethyl)-3-(3,4-dimethylphenyl)-N-(2-thiazolyl)-4-pyrazolecarboxamide IUPAC Name: 1-(2-cyanoethyl)-3-(3,4-dimethylphenyl)-N-(1,3-thiazol-2-yl)pyrazole-4-carboxamide Traditional Name: 1-(2-cyanoethyl)-3-(3,4-dimethylphenyl)-N-thiazol-2-yl-pyrazole-4-carboxamide Formula: C18H17N5OS MolecularWeight: 351.42548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C=C2C(=O)NC3=NC=CS3)CCC#N)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C=C2C(=O)NC3=NC=CS3)CCC#N)C

InChI

InChI=1S/C18H17N5OS/c1-12-4-5-14(10-13(12)2)16-15(11-23(22-16)8-3-6-19)17(24)21-18-20-7-9-25-18/h4-5,7,9-11H,3,8H2,1-2H3,(H,20,21,24)