(E)-3-[4-(3,5-diphenylpyrazol-1-yl)phenyl]-2-(4-oxidanylidene-1H-quinazolin-2-yl)prop-2-enenitrile

Systemtic Name: (E)-3-[4-(3,5-diphenylpyrazol-1-yl)phenyl]-2-(4-oxidanylidene-1H-quinazolin-2-yl)prop-2-enenitrile Openeye Name: (E)-3-[4-(3,5-diphenylpyrazol-1-yl)phenyl]-2-(4-oxo-1H-quinazolin-2-yl)prop-2-enenitrile CAS Name: (E)-3-[4-(3,5-diphenyl-1-pyrazolyl)phenyl]-2-(4-oxo-1H-quinazolin-2-yl)-2-propenenitrile IUPAC Name: (E)-3-[4-(3,5-diphenylpyrazol-1-yl)phenyl]-2-(4-oxo-1H-quinazolin-2-yl)prop-2-enenitrile Traditional Name: (E)-3-[4-(3,5-diphenylpyrazol-1-yl)phenyl]-2-(4-keto-1H-quinazolin-2-yl)acrylonitrile Formula: C32H21N5O MolecularWeight: 491.54204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)C=C(C#N)C4=NC(=O)C5=CC=CC=C5N4)C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)/C=C(\C#N)/C4=NC(=O)C5=CC=CC=C5N4)C6=CC=CC=C6

InChI

InChI=1S/C32H21N5O/c33-21-25(31-34-28-14-8-7-13-27(28)32(38)35-31)19-22-15-17-26(18-16-22)37-30(24-11-5-2-6-12-24)20-29(36-37)23-9-3-1-4-10-23/h1-20H,(H,34,35,38)/b25-19+