4-[6,8-bis(chloranyl)-4-oxidanylidene-quinazolin-3-yl]-2-(1,3-dimethylbenzimidazol-2-ylidene)-3-oxidanylidene-butanenitrile

Systemtic Name: 4-[6,8-bis(chloranyl)-4-oxidanylidene-quinazolin-3-yl]-2-(1,3-dimethylbenzimidazol-2-ylidene)-3-oxidanylidene-butanenitrile Openeye Name: 4-(6,8-dichloro-4-oxo-quinazolin-3-yl)-2-(1,3-dimethylbenzimidazol-2-ylidene)-3-oxo-butanenitrile CAS Name: 4-(6,8-dichloro-4-oxo-3-quinazolinyl)-2-(1,3-dimethyl-2-benzimidazolylidene)-3-oxobutanenitrile IUPAC Name: 4-(6,8-dichloro-4-oxoquinazolin-3-yl)-2-(1,3-dimethylbenzimidazol-2-ylidene)-3-oxobutanenitrile Traditional Name: 4-(6,8-dichloro-4-keto-quinazolin-3-yl)-2-(1,3-dimethylbenzimidazol-2-ylidene)-3-keto-butyronitrile Formula: C21H15Cl2N5O2 MolecularWeight: 440.2821

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N(C1=C(C#N)C(=O)CN3C=NC4=C(C=C(C=C4C3=O)Cl)Cl)C

Isomeric SMILES

CN1C2=CC=CC=C2N(C1=C(C#N)C(=O)CN3C=NC4=C(C=C(C=C4C3=O)Cl)Cl)C

InChI

InChI=1S/C21H15Cl2N5O2/c1-26-16-5-3-4-6-17(16)27(2)20(26)14(9-24)18(29)10-28-11-25-19-13(21(28)30)7-12(22)8-15(19)23/h3-8,11H,10H2,1-2H3