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

Systemtic Name: (E)-2-cyano-N-cyclopentyl-3-[3-(4-methoxyphenyl)-1-(phenylmethyl)pyrazol-4-yl]prop-2-enamide Openeye Name: (E)-3-[1-benzyl-3-(4-methoxyphenyl)pyrazol-4-yl]-2-cyano-N-cyclopentyl-prop-2-enamide CAS Name: (E)-2-cyano-N-cyclopentyl-3-[3-(4-methoxyphenyl)-1-(phenylmethyl)-4-pyrazolyl]-2-propenamide IUPAC Name: (E)-3-[1-benzyl-3-(4-methoxyphenyl)pyrazol-4-yl]-2-cyano-N-cyclopentylprop-2-enamide Traditional Name: (E)-3-[1-benzyl-3-(4-methoxyphenyl)pyrazol-4-yl]-2-cyano-N-cyclopentyl-acrylamide Formula: C26H26N4O2 MolecularWeight: 426.51024

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C=C2C=C(C#N)C(=O)NC3CCCC3)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C=C2/C=C(\C#N)/C(=O)NC3CCCC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H26N4O2/c1-32-24-13-11-20(12-14-24)25-22(18-30(29-25)17-19-7-3-2-4-8-19)15-21(16-27)26(31)28-23-9-5-6-10-23/h2-4,7-8,11-15,18,23H,5-6,9-10,17H2,1H3,(H,28,31)/b21-15+