N-(4-cyano-2-phenyl-pyrazol-3-yl)-1-[(4-phenylphenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-(4-cyano-2-phenyl-pyrazol-3-yl)-1-[(4-phenylphenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-(4-cyano-2-phenyl-pyrazol-3-yl)-1-[(4-phenylphenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-(4-cyano-2-phenyl-3-pyrazolyl)-1-[(4-phenylphenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(4-cyano-2-phenylpyrazol-3-yl)-1-[(4-phenylphenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-(4-cyano-2-phenyl-pyrazol-3-yl)-1-[(4-phenylphenoxy)methyl]pyrazole-3-carboxamide Formula: C27H20N6O2 MolecularWeight: 460.4867

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)OCN3C=CC(=N3)C(=O)NC4=C(C=NN4C5=CC=CC=C5)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)OCN3C=CC(=N3)C(=O)NC4=C(C=NN4C5=CC=CC=C5)C#N

InChI

InChI=1S/C27H20N6O2/c28-17-22-18-29-33(23-9-5-2-6-10-23)26(22)30-27(34)25-15-16-32(31-25)19-35-24-13-11-21(12-14-24)20-7-3-1-4-8-20/h1-16,18H,19H2,(H,30,34)