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

Systemtic Name: (E)-3-[3-(4-butoxyphenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-methyl-prop-2-enamide Openeye Name: (E)-3-[3-(4-butoxyphenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-methyl-prop-2-enamide CAS Name: (E)-3-[3-(4-butoxyphenyl)-1-phenyl-4-pyrazolyl]-2-cyano-N-methyl-2-propenamide IUPAC Name: (E)-3-[3-(4-butoxyphenyl)-1-phenylpyrazol-4-yl]-2-cyano-N-methylprop-2-enamide Traditional Name: (E)-3-[3-(4-butoxyphenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-methyl-acrylamide Formula: C24H24N4O2 MolecularWeight: 400.47296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=NN(C=C2C=C(C#N)C(=O)NC)C3=CC=CC=C3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=NN(C=C2/C=C(\C#N)/C(=O)NC)C3=CC=CC=C3

InChI

InChI=1S/C24H24N4O2/c1-3-4-14-30-22-12-10-18(11-13-22)23-20(15-19(16-25)24(29)26-2)17-28(27-23)21-8-6-5-7-9-21/h5-13,15,17H,3-4,14H2,1-2H3,(H,26,29)/b19-15+