N-(4-cyano-2-phenyl-pyrazol-3-yl)-1-(phenoxymethyl)pyrazole-3-carboxamide

Systemtic Name: N-(4-cyano-2-phenyl-pyrazol-3-yl)-1-(phenoxymethyl)pyrazole-3-carboxamide Openeye Name: N-(4-cyano-2-phenyl-pyrazol-3-yl)-1-(phenoxymethyl)pyrazole-3-carboxamide CAS Name: N-(4-cyano-2-phenyl-3-pyrazolyl)-1-(phenoxymethyl)-3-pyrazolecarboxamide IUPAC Name: N-(4-cyano-2-phenylpyrazol-3-yl)-1-(phenoxymethyl)pyrazole-3-carboxamide Traditional Name: N-(4-cyano-2-phenyl-pyrazol-3-yl)-1-(phenoxymethyl)pyrazole-3-carboxamide Formula: C21H16N6O2 MolecularWeight: 384.39074

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=C(C=N2)C#N)NC(=O)C3=NN(C=C3)COC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)N2C(=C(C=N2)C#N)NC(=O)C3=NN(C=C3)COC4=CC=CC=C4

InChI

InChI=1S/C21H16N6O2/c22-13-16-14-23-27(17-7-3-1-4-8-17)20(16)24-21(28)19-11-12-26(25-19)15-29-18-9-5-2-6-10-18/h1-12,14H,15H2,(H,24,28)