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

Systemtic Name: 3-(2-methyl-4-oxidanylidene-1-phenacyl-pyrimido[1,2-a]benzimidazol-3-yl)propanenitrile Openeye Name: 3-(2-methyl-4-oxo-1-phenacyl-pyrimido[1,2-a]benzimidazol-3-yl)propanenitrile CAS Name: 3-(2-methyl-4-oxo-1-phenacyl-3-pyrimido[1,2-a]benzimidazolyl)propanenitrile IUPAC Name: 3-(2-methyl-4-oxo-1-phenacylpyrimido[1,2-a]benzimidazol-3-yl)propanenitrile Traditional Name: 3-(4-keto-2-methyl-1-phenacyl-pyrimido[1,2-a]benzimidazol-3-yl)propionitrile Formula: C22H18N4O2 MolecularWeight: 370.40392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N2C3=CC=CC=C3N=C2N1CC(=O)C4=CC=CC=C4)CCC#N

Isomeric SMILES

CC1=C(C(=O)N2C3=CC=CC=C3N=C2N1CC(=O)C4=CC=CC=C4)CCC#N

InChI

InChI=1S/C22H18N4O2/c1-15-17(10-7-13-23)21(28)26-19-12-6-5-11-18(19)24-22(26)25(15)14-20(27)16-8-3-2-4-9-16/h2-6,8-9,11-12H,7,10,14H2,1H3