3-(4-methoxyphenyl)-1-oxidanylidene-3-(trifluoromethyl)-2,5-dihydropyrimido[1,6-a]benzimidazole-4-carbonitrile

Systemtic Name: 3-(4-methoxyphenyl)-1-oxidanylidene-3-(trifluoromethyl)-2,5-dihydropyrimido[1,6-a]benzimidazole-4-carbonitrile Openeye Name: 3-(4-methoxyphenyl)-1-oxo-3-(trifluoromethyl)-2,5-dihydropyrimido[1,6-a]benzimidazole-4-carbonitrile CAS Name: 3-(4-methoxyphenyl)-1-oxo-3-(trifluoromethyl)-2,5-dihydropyrimido[1,6-a]benzimidazole-4-carbonitrile IUPAC Name: 3-(4-methoxyphenyl)-1-oxo-3-(trifluoromethyl)-2,5-dihydropyrimido[1,6-a]benzimidazole-4-carbonitrile Traditional Name: 1-keto-3-(4-methoxyphenyl)-3-(trifluoromethyl)-2,5-dihydropyrimido[1,6-a]benzimidazole-4-carbonitrile Formula: C19H13F3N4O2 MolecularWeight: 386.32733

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2(C(=C3NC4=CC=CC=C4N3C(=O)N2)C#N)C(F)(F)F

Isomeric SMILES

COC1=CC=C(C=C1)C2(C(=C3NC4=CC=CC=C4N3C(=O)N2)C#N)C(F)(F)F

InChI

InChI=1S/C19H13F3N4O2/c1-28-12-8-6-11(7-9-12)18(19(20,21)22)13(10-23)16-24-14-4-2-3-5-15(14)26(16)17(27)25-18/h2-9,24H,1H3,(H,25,27)