(E)-2-(1H-benzimidazol-2-yl)-3-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]prop-2-enenitrile

Systemtic Name: (E)-2-(1H-benzimidazol-2-yl)-3-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]prop-2-enenitrile Openeye Name: (E)-2-(1H-benzimidazol-2-yl)-3-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]prop-2-enenitrile CAS Name: (E)-2-(1H-benzimidazol-2-yl)-3-[3-(4-nitrophenyl)-1-phenyl-4-pyrazolyl]-2-propenenitrile IUPAC Name: (E)-2-(1H-benzimidazol-2-yl)-3-[3-(4-nitrophenyl)-1-phenylpyrazol-4-yl]prop-2-enenitrile Traditional Name: (E)-2-(1H-benzimidazol-2-yl)-3-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]acrylonitrile Formula: C25H16N6O2 MolecularWeight: 432.43354

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)[N+](=O)[O-])C=C(C#N)C4=NC5=CC=CC=C5N4

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)[N+](=O)[O-])/C=C(\C#N)/C4=NC5=CC=CC=C5N4

InChI

InChI=1S/C25H16N6O2/c26-15-18(25-27-22-8-4-5-9-23(22)28-25)14-19-16-30(20-6-2-1-3-7-20)29-24(19)17-10-12-21(13-11-17)31(32)33/h1-14,16H,(H,27,28)/b18-14+