methyl 4-cyano-1-phenyl-5-phenylazanyl-pyrazole-3-carboxylate

Systemtic Name: methyl 4-cyano-1-phenyl-5-phenylazanyl-pyrazole-3-carboxylate Openeye Name: methyl 5-anilino-4-cyano-1-phenyl-pyrazole-3-carboxylate CAS Name: 5-anilino-4-cyano-1-phenyl-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 5-anilino-4-cyano-1-phenylpyrazole-3-carboxylate Traditional Name: 5-anilino-4-cyano-1-phenyl-pyrazole-3-carboxylic acid methyl ester Formula: C18H14N4O2 MolecularWeight: 318.32936

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NN(C(=C1C#N)NC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=NN(C(=C1C#N)NC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C18H14N4O2/c1-24-18(23)16-15(12-19)17(20-13-8-4-2-5-9-13)22(21-16)14-10-6-3-7-11-14/h2-11,20H,1H3