(Z)-3-[3-(3-methoxyphenyl)-1-(phenylmethyl)pyrazol-4-yl]-2-pyridin-2-yl-prop-2-enenitrile

Systemtic Name: (Z)-3-[3-(3-methoxyphenyl)-1-(phenylmethyl)pyrazol-4-yl]-2-pyridin-2-yl-prop-2-enenitrile Openeye Name: (Z)-3-[1-benzyl-3-(3-methoxyphenyl)pyrazol-4-yl]-2-(2-pyridyl)prop-2-enenitrile CAS Name: (Z)-3-[3-(3-methoxyphenyl)-1-(phenylmethyl)-4-pyrazolyl]-2-(2-pyridinyl)-2-propenenitrile IUPAC Name: (Z)-3-[1-benzyl-3-(3-methoxyphenyl)pyrazol-4-yl]-2-pyridin-2-ylprop-2-enenitrile Traditional Name: (Z)-3-[1-benzyl-3-(3-methoxyphenyl)pyrazol-4-yl]-2-(2-pyridyl)acrylonitrile Formula: C25H20N4O MolecularWeight: 392.4525

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NN(C=C2C=C(C#N)C3=CC=CC=N3)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)C2=NN(C=C2/C=C(\C#N)/C3=CC=CC=N3)CC4=CC=CC=C4

InChI

InChI=1S/C25H20N4O/c1-30-23-11-7-10-20(15-23)25-22(14-21(16-26)24-12-5-6-13-27-24)18-29(28-25)17-19-8-3-2-4-9-19/h2-15,18H,17H2,1H3/b21-14+