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

Systemtic Name: (E)-3-[3-(3-nitrophenyl)-1-phenyl-pyrazol-4-yl]-2-(4-oxidanylidene-1H-quinazolin-2-yl)prop-2-enenitrile Openeye Name: (E)-3-[3-(3-nitrophenyl)-1-phenyl-pyrazol-4-yl]-2-(4-oxo-1H-quinazolin-2-yl)prop-2-enenitrile CAS Name: (E)-3-[3-(3-nitrophenyl)-1-phenyl-4-pyrazolyl]-2-(4-oxo-1H-quinazolin-2-yl)-2-propenenitrile IUPAC Name: (E)-3-[3-(3-nitrophenyl)-1-phenylpyrazol-4-yl]-2-(4-oxo-1H-quinazolin-2-yl)prop-2-enenitrile Traditional Name: (E)-2-(4-keto-1H-quinazolin-2-yl)-3-[3-(3-nitrophenyl)-1-phenyl-pyrazol-4-yl]acrylonitrile Formula: C26H16N6O3 MolecularWeight: 460.44364

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC(=CC=C3)[N+](=O)[O-])C=C(C#N)C4=NC(=O)C5=CC=CC=C5N4

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC(=CC=C3)[N+](=O)[O-])/C=C(\C#N)/C4=NC(=O)C5=CC=CC=C5N4

InChI

InChI=1S/C26H16N6O3/c27-15-18(25-28-23-12-5-4-11-22(23)26(33)29-25)13-19-16-31(20-8-2-1-3-9-20)30-24(19)17-7-6-10-21(14-17)32(34)35/h1-14,16H,(H,28,29,33)/b18-13+