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

Systemtic Name: ethyl 4-(3-ethoxyphenyl)-2-oxidanylidene-1-pentyl-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Openeye Name: ethyl 4-(3-ethoxyphenyl)-2-oxo-1-pentyl-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate CAS Name: 4-(3-ethoxyphenyl)-2-oxo-1-pentyl-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-ethoxyphenyl)-2-oxo-1-pentyl-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Traditional Name: 1-amyl-2-keto-4-m-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=C4)OCC)C(=O)OCC

Isomeric SMILES

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

InChI

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