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

Systemtic Name: (E)-2-cyano-3-[3-(4-ethylphenyl)-1-(phenylmethyl)pyrazol-4-yl]-N-methyl-prop-2-enamide Openeye Name: (E)-3-[1-benzyl-3-(4-ethylphenyl)pyrazol-4-yl]-2-cyano-N-methyl-prop-2-enamide CAS Name: (E)-2-cyano-3-[3-(4-ethylphenyl)-1-(phenylmethyl)-4-pyrazolyl]-N-methyl-2-propenamide IUPAC Name: (E)-3-[1-benzyl-3-(4-ethylphenyl)pyrazol-4-yl]-2-cyano-N-methylprop-2-enamide Traditional Name: (E)-3-[1-benzyl-3-(4-ethylphenyl)pyrazol-4-yl]-2-cyano-N-methyl-acrylamide Formula: C23H22N4O MolecularWeight: 370.44698

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NN(C=C2C=C(C#N)C(=O)NC)CC3=CC=CC=C3

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NN(C=C2/C=C(\C#N)/C(=O)NC)CC3=CC=CC=C3

InChI

InChI=1S/C23H22N4O/c1-3-17-9-11-19(12-10-17)22-21(13-20(14-24)23(28)25-2)16-27(26-22)15-18-7-5-4-6-8-18/h4-13,16H,3,15H2,1-2H3,(H,25,28)/b20-13+