(E)-2-(1-methylbenzimidazol-2-yl)-3-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)prop-2-enenitrile

Systemtic Name: (E)-2-(1-methylbenzimidazol-2-yl)-3-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)prop-2-enenitrile Openeye Name: (E)-2-(1-methylbenzimidazol-2-yl)-3-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]prop-2-enenitrile CAS Name: (E)-2-(1-methyl-2-benzimidazolyl)-3-[1-phenyl-3-(3-pyridinyl)-4-pyrazolyl]-2-propenenitrile IUPAC Name: (E)-2-(1-methylbenzimidazol-2-yl)-3-(1-phenyl-3-pyridin-3-ylpyrazol-4-yl)prop-2-enenitrile Traditional Name: (E)-2-(1-methylbenzimidazol-2-yl)-3-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]acrylonitrile Formula: C25H18N6 MolecularWeight: 402.45062

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H18N6/c1-30-23-12-6-5-11-22(23)28-25(30)19(15-26)14-20-17-31(21-9-3-2-4-10-21)29-24(20)18-8-7-13-27-16-18/h2-14,16-17H,1H3/b19-14+