(E)-2-(1-methylbenzimidazol-2-yl)-3-[1-(phenylmethyl)-3-pyridin-3-yl-pyrazol-4-yl]prop-2-enenitrile

Systemtic Name: (E)-2-(1-methylbenzimidazol-2-yl)-3-[1-(phenylmethyl)-3-pyridin-3-yl-pyrazol-4-yl]prop-2-enenitrile Openeye Name: (E)-3-[1-benzyl-3-(3-pyridyl)pyrazol-4-yl]-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile CAS Name: (E)-2-(1-methyl-2-benzimidazolyl)-3-[1-(phenylmethyl)-3-(3-pyridinyl)-4-pyrazolyl]-2-propenenitrile IUPAC Name: (E)-3-(1-benzyl-3-pyridin-3-ylpyrazol-4-yl)-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile Traditional Name: (E)-3-[1-benzyl-3-(3-pyridyl)pyrazol-4-yl]-2-(1-methylbenzimidazol-2-yl)acrylonitrile Formula: C26H20N6 MolecularWeight: 416.4772

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1C(=CC3=CN(N=C3C4=CN=CC=C4)CC5=CC=CC=C5)C#N

Isomeric SMILES

CN1C2=CC=CC=C2N=C1/C(=C/C3=CN(N=C3C4=CN=CC=C4)CC5=CC=CC=C5)/C#N

InChI

InChI=1S/C26H20N6/c1-31-24-12-6-5-11-23(24)29-26(31)21(15-27)14-22-18-32(17-19-8-3-2-4-9-19)30-25(22)20-10-7-13-28-16-20/h2-14,16,18H,17H2,1H3/b21-14+