(2Z)-4-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxidanylidene-2-(4-oxidanylidene-1H-quinazolin-2-ylidene)butanenitrile

Systemtic Name: (2Z)-4-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxidanylidene-2-(4-oxidanylidene-1H-quinazolin-2-ylidene)butanenitrile Openeye Name: (2Z)-4-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxo-2-(4-oxo-1H-quinazolin-2-ylidene)butanenitrile CAS Name: (2Z)-4-[4-(4-fluorophenyl)-1-piperazinyl]-3-oxo-2-(4-oxo-1H-quinazolin-2-ylidene)butanenitrile IUPAC Name: (2Z)-4-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxo-2-(4-oxo-1H-quinazolin-2-ylidene)butanenitrile Traditional Name: (2Z)-4-[4-(4-fluorophenyl)piperazino]-3-keto-2-(4-keto-1H-quinazolin-2-ylidene)butyronitrile Formula: C22H20FN5O2 MolecularWeight: 405.424903

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)C(=C2NC3=CC=CC=C3C(=O)N2)C#N)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCN1CC(=O)/C(=C\2/NC3=CC=CC=C3C(=O)N2)/C#N)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H20FN5O2/c23-15-5-7-16(8-6-15)28-11-9-27(10-12-28)14-20(29)18(13-24)21-25-19-4-2-1-3-17(19)22(30)26-21/h1-8,25H,9-12,14H2,(H,26,30)/b21-18-