(E)-2-(4-oxidanylidene-1H-quinazolin-2-yl)-3-(5-phenyl-1H-pyrazol-4-yl)prop-2-enenitrile

Systemtic Name: (E)-2-(4-oxidanylidene-1H-quinazolin-2-yl)-3-(5-phenyl-1H-pyrazol-4-yl)prop-2-enenitrile Openeye Name: (E)-2-(4-oxo-1H-quinazolin-2-yl)-3-(5-phenyl-1H-pyrazol-4-yl)prop-2-enenitrile CAS Name: (E)-2-(4-oxo-1H-quinazolin-2-yl)-3-(5-phenyl-1H-pyrazol-4-yl)-2-propenenitrile IUPAC Name: (E)-2-(4-oxo-1H-quinazolin-2-yl)-3-(5-phenyl-1H-pyrazol-4-yl)prop-2-enenitrile Traditional Name: (E)-2-(4-keto-1H-quinazolin-2-yl)-3-(5-phenyl-1H-pyrazol-4-yl)acrylonitrile Formula: C20H13N5O MolecularWeight: 339.35012

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C=NN2)C=C(C#N)C3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C=NN2)/C=C(\C#N)/C3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C20H13N5O/c21-11-14(19-23-17-9-5-4-8-16(17)20(26)24-19)10-15-12-22-25-18(15)13-6-2-1-3-7-13/h1-10,12H,(H,22,25)(H,23,24,26)/b14-10+