1-(2-cyanoethyl)-3-(3,4-dimethoxyphenyl)-N-naphthalen-2-yl-pyrazole-4-carboxamide

Systemtic Name: 1-(2-cyanoethyl)-3-(3,4-dimethoxyphenyl)-N-naphthalen-2-yl-pyrazole-4-carboxamide Openeye Name: 1-(2-cyanoethyl)-3-(3,4-dimethoxyphenyl)-N-(2-naphthyl)pyrazole-4-carboxamide CAS Name: 1-(2-cyanoethyl)-3-(3,4-dimethoxyphenyl)-N-(2-naphthalenyl)-4-pyrazolecarboxamide IUPAC Name: 1-(2-cyanoethyl)-3-(3,4-dimethoxyphenyl)-N-naphthalen-2-ylpyrazole-4-carboxamide Traditional Name: 1-(2-cyanoethyl)-3-(3,4-dimethoxyphenyl)-N-(2-naphthyl)pyrazole-4-carboxamide Formula: C25H22N4O3 MolecularWeight: 426.46718

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C=C2C(=O)NC3=CC4=CC=CC=C4C=C3)CCC#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C=C2C(=O)NC3=CC4=CC=CC=C4C=C3)CCC#N)OC

InChI

InChI=1S/C25H22N4O3/c1-31-22-11-9-19(15-23(22)32-2)24-21(16-29(28-24)13-5-12-26)25(30)27-20-10-8-17-6-3-4-7-18(17)14-20/h3-4,6-11,14-16H,5,13H2,1-2H3,(H,27,30)