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

Systemtic Name: 3-(4-chlorophenyl)-1-(2-cyanoethyl)-N-(1,3-thiazol-2-yl)pyrazole-4-carboxamide Openeye Name: 3-(4-chlorophenyl)-1-(2-cyanoethyl)-N-thiazol-2-yl-pyrazole-4-carboxamide CAS Name: 3-(4-chlorophenyl)-1-(2-cyanoethyl)-N-(2-thiazolyl)-4-pyrazolecarboxamide IUPAC Name: 3-(4-chlorophenyl)-1-(2-cyanoethyl)-N-(1,3-thiazol-2-yl)pyrazole-4-carboxamide Traditional Name: 3-(4-chlorophenyl)-1-(2-cyanoethyl)-N-thiazol-2-yl-pyrazole-4-carboxamide Formula: C16H12ClN5OS MolecularWeight: 357.81738

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NN(C=C2C(=O)NC3=NC=CS3)CCC#N)Cl

Isomeric SMILES

C1=CC(=CC=C1C2=NN(C=C2C(=O)NC3=NC=CS3)CCC#N)Cl

InChI

InChI=1S/C16H12ClN5OS/c17-12-4-2-11(3-5-12)14-13(10-22(21-14)8-1-6-18)15(23)20-16-19-7-9-24-16/h2-5,7,9-10H,1,8H2,(H,19,20,23)