3-(3-ethyl-2-methyl-4-oxidanylidene-pyrimido[1,2-a]benzimidazol-1-yl)propanenitrile

Systemtic Name: 3-(3-ethyl-2-methyl-4-oxidanylidene-pyrimido[1,2-a]benzimidazol-1-yl)propanenitrile Openeye Name: 3-(3-ethyl-2-methyl-4-oxo-pyrimido[1,2-a]benzimidazol-1-yl)propanenitrile CAS Name: 3-(3-ethyl-2-methyl-4-oxo-1-pyrimido[1,2-a]benzimidazolyl)propanenitrile IUPAC Name: 3-(3-ethyl-2-methyl-4-oxopyrimido[1,2-a]benzimidazol-1-yl)propanenitrile Traditional Name: 3-(3-ethyl-4-keto-2-methyl-pyrimido[1,2-a]benzimidazol-1-yl)propionitrile Formula: C16H16N4O MolecularWeight: 280.32444

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(C2=NC3=CC=CC=C3N2C1=O)CCC#N)C

Isomeric SMILES

CCC1=C(N(C2=NC3=CC=CC=C3N2C1=O)CCC#N)C

InChI

InChI=1S/C16H16N4O/c1-3-12-11(2)19(10-6-9-17)16-18-13-7-4-5-8-14(13)20(16)15(12)21/h4-5,7-8H,3,6,10H2,1-2H3