1-(2-cyanoethyl)-N-(4-ethanoylphenyl)-3-(4-methoxyphenyl)pyrazole-4-carboxamide

Systemtic Name: 1-(2-cyanoethyl)-N-(4-ethanoylphenyl)-3-(4-methoxyphenyl)pyrazole-4-carboxamide Openeye Name: N-(4-acetylphenyl)-1-(2-cyanoethyl)-3-(4-methoxyphenyl)pyrazole-4-carboxamide CAS Name: N-(4-acetylphenyl)-1-(2-cyanoethyl)-3-(4-methoxyphenyl)-4-pyrazolecarboxamide IUPAC Name: N-(4-acetylphenyl)-1-(2-cyanoethyl)-3-(4-methoxyphenyl)pyrazole-4-carboxamide Traditional Name: N-(4-acetylphenyl)-1-(2-cyanoethyl)-3-(4-methoxyphenyl)pyrazole-4-carboxamide Formula: C22H20N4O3 MolecularWeight: 388.4192

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)NC(=O)C2=CN(N=C2C3=CC=C(C=C3)OC)CCC#N

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC(=O)C2=CN(N=C2C3=CC=C(C=C3)OC)CCC#N

InChI

InChI=1S/C22H20N4O3/c1-15(27)16-4-8-18(9-5-16)24-22(28)20-14-26(13-3-12-23)25-21(20)17-6-10-19(29-2)11-7-17/h4-11,14H,3,13H2,1-2H3,(H,24,28)