ethyl 1-butyl-4-(2-ethoxyphenyl)-2-oxidanylidene-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate

Systemtic Name: ethyl 1-butyl-4-(2-ethoxyphenyl)-2-oxidanylidene-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Openeye Name: ethyl 1-butyl-4-(2-ethoxyphenyl)-2-oxo-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate CAS Name: 1-butyl-4-(2-ethoxyphenyl)-2-oxo-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 1-butyl-4-(2-ethoxyphenyl)-2-oxo-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Traditional Name: 1-butyl-2-keto-4-o-phenetyl-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylic acid ethyl ester Formula: C25H29N3O4 MolecularWeight: 435.51546

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(C(N2C1=NC3=CC=CC=C32)C4=CC=CC=C4OCC)C(=O)OCC

Isomeric SMILES

CCCCN1C(=O)C(C(N2C1=NC3=CC=CC=C32)C4=CC=CC=C4OCC)C(=O)OCC

InChI

InChI=1S/C25H29N3O4/c1-4-7-16-27-23(29)21(24(30)32-6-3)22(17-12-8-11-15-20(17)31-5-2)28-19-14-10-9-13-18(19)26-25(27)28/h8-15,21-22H,4-7,16H2,1-3H3