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

Systemtic Name: 1-(2-cyanoethyl)-3-(4-methoxyphenyl)-N,N-diphenyl-pyrazole-4-carboxamide Openeye Name: 1-(2-cyanoethyl)-3-(4-methoxyphenyl)-N,N-diphenyl-pyrazole-4-carboxamide CAS Name: 1-(2-cyanoethyl)-3-(4-methoxyphenyl)-N,N-diphenyl-4-pyrazolecarboxamide IUPAC Name: 1-(2-cyanoethyl)-3-(4-methoxyphenyl)-N,N-diphenylpyrazole-4-carboxamide Traditional Name: 1-(2-cyanoethyl)-3-(4-methoxyphenyl)-N,N-diphenyl-pyrazole-4-carboxamide Formula: C26H22N4O2 MolecularWeight: 422.47848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C=C2C(=O)N(C3=CC=CC=C3)C4=CC=CC=C4)CCC#N

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C=C2C(=O)N(C3=CC=CC=C3)C4=CC=CC=C4)CCC#N

InChI

InChI=1S/C26H22N4O2/c1-32-23-15-13-20(14-16-23)25-24(19-29(28-25)18-8-17-27)26(31)30(21-9-4-2-5-10-21)22-11-6-3-7-12-22/h2-7,9-16,19H,8,18H2,1H3