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

Systemtic Name: ethyl 4-(2-ethoxyphenyl)-2-oxidanylidene-1-pentyl-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Openeye Name: ethyl 4-(2-ethoxyphenyl)-2-oxo-1-pentyl-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate CAS Name: 4-(2-ethoxyphenyl)-2-oxo-1-pentyl-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-ethoxyphenyl)-2-oxo-1-pentyl-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Traditional Name: 1-amyl-2-keto-4-o-phenetyl-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylic acid ethyl ester Formula: C26H31N3O4 MolecularWeight: 449.54204

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C(C(N2C1=NC3=CC=CC=C32)C4=CC=CC=C4OCC)C(=O)OCC

Isomeric SMILES

CCCCCN1C(=O)C(C(N2C1=NC3=CC=CC=C32)C4=CC=CC=C4OCC)C(=O)OCC

InChI

InChI=1S/C26H31N3O4/c1-4-7-12-17-28-24(30)22(25(31)33-6-3)23(18-13-8-11-16-21(18)32-5-2)29-20-15-10-9-14-19(20)27-26(28)29/h8-11,13-16,22-23H,4-7,12,17H2,1-3H3