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

Systemtic Name: 1-(2-cyanoethyl)-N,N,3-triphenyl-pyrazole-4-carboxamide Openeye Name: 1-(2-cyanoethyl)-N,N,3-triphenyl-pyrazole-4-carboxamide CAS Name: 1-(2-cyanoethyl)-N,N,3-triphenyl-4-pyrazolecarboxamide IUPAC Name: 1-(2-cyanoethyl)-N,N,3-triphenylpyrazole-4-carboxamide Traditional Name: 1-(2-cyanoethyl)-N,N,3-triphenyl-pyrazole-4-carboxamide Formula: C25H20N4O MolecularWeight: 392.4525

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H20N4O/c26-17-10-18-28-19-23(24(27-28)20-11-4-1-5-12-20)25(30)29(21-13-6-2-7-14-21)22-15-8-3-9-16-22/h1-9,11-16,19H,10,18H2