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

Systemtic Name: 1-(2-cyanoethyl)-3-phenyl-N-(1,3-thiazol-2-yl)pyrazole-4-carboxamide Openeye Name: 1-(2-cyanoethyl)-3-phenyl-N-thiazol-2-yl-pyrazole-4-carboxamide CAS Name: 1-(2-cyanoethyl)-3-phenyl-N-(2-thiazolyl)-4-pyrazolecarboxamide IUPAC Name: 1-(2-cyanoethyl)-3-phenyl-N-(1,3-thiazol-2-yl)pyrazole-4-carboxamide Traditional Name: 1-(2-cyanoethyl)-3-phenyl-N-thiazol-2-yl-pyrazole-4-carboxamide Formula: C16H13N5OS MolecularWeight: 323.37232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13N5OS/c17-7-4-9-21-11-13(15(22)19-16-18-8-10-23-16)14(20-21)12-5-2-1-3-6-12/h1-3,5-6,8,10-11H,4,9H2,(H,18,19,22)