(2E)-3-oxidanylidene-2-(4-oxidanylidene-1H-quinazolin-2-ylidene)-4-pyrrolidin-1-yl-butanenitrile

Systemtic Name: (2E)-3-oxidanylidene-2-(4-oxidanylidene-1H-quinazolin-2-ylidene)-4-pyrrolidin-1-yl-butanenitrile Openeye Name: (2E)-3-oxo-2-(4-oxo-1H-quinazolin-2-ylidene)-4-pyrrolidin-1-yl-butanenitrile CAS Name: (2E)-3-oxo-2-(4-oxo-1H-quinazolin-2-ylidene)-4-(1-pyrrolidinyl)butanenitrile IUPAC Name: (2E)-3-oxo-2-(4-oxo-1H-quinazolin-2-ylidene)-4-pyrrolidin-1-ylbutanenitrile Traditional Name: (2E)-3-keto-2-(4-keto-1H-quinazolin-2-ylidene)-4-pyrrolidino-butyronitrile Formula: C16H16N4O2 MolecularWeight: 296.32384

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC(=O)C(=C2NC3=CC=CC=C3C(=O)N2)C#N

Isomeric SMILES

C1CCN(C1)CC(=O)/C(=C/2\NC3=CC=CC=C3C(=O)N2)/C#N

InChI

InChI=1S/C16H16N4O2/c17-9-12(14(21)10-20-7-3-4-8-20)15-18-13-6-2-1-5-11(13)16(22)19-15/h1-2,5-6,18H,3-4,7-8,10H2,(H,19,22)/b15-12+