(E)-2-cyano-N-methyl-3-[3-(4-methylphenyl)-1-phenyl-pyrazol-4-yl]prop-2-enamide

Systemtic Name: (E)-2-cyano-N-methyl-3-[3-(4-methylphenyl)-1-phenyl-pyrazol-4-yl]prop-2-enamide Openeye Name: (E)-2-cyano-N-methyl-3-[1-phenyl-3-(p-tolyl)pyrazol-4-yl]prop-2-enamide CAS Name: (E)-2-cyano-N-methyl-3-[3-(4-methylphenyl)-1-phenyl-4-pyrazolyl]-2-propenamide IUPAC Name: (E)-2-cyano-N-methyl-3-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]prop-2-enamide Traditional Name: (E)-2-cyano-N-methyl-3-[1-phenyl-3-(p-tolyl)pyrazol-4-yl]acrylamide Formula: C21H18N4O MolecularWeight: 342.39382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C=C2C=C(C#N)C(=O)NC)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C=C2/C=C(\C#N)/C(=O)NC)C3=CC=CC=C3

InChI

InChI=1S/C21H18N4O/c1-15-8-10-16(11-9-15)20-18(12-17(13-22)21(26)23-2)14-25(24-20)19-6-4-3-5-7-19/h3-12,14H,1-2H3,(H,23,26)/b17-12+