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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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