ethyl 4-(4-butoxy-3-methoxy-phenyl)-2-propyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate

Systemtic Name: ethyl 4-(4-butoxy-3-methoxy-phenyl)-2-propyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Openeye Name: ethyl 4-(4-butoxy-3-methoxy-phenyl)-2-propyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate CAS Name: 4-(4-butoxy-3-methoxyphenyl)-2-propyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-butoxy-3-methoxyphenyl)-2-propyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Traditional Name: 4-(4-butoxy-3-methoxy-phenyl)-2-propyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylic acid ethyl ester Formula: C27H33N3O4 MolecularWeight: 463.56862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C2C(=C(NC3=NC4=CC=CC=C4N23)CCC)C(=O)OCC)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C2C(=C(NC3=NC4=CC=CC=C4N23)CCC)C(=O)OCC)OC

InChI

InChI=1S/C27H33N3O4/c1-5-8-16-34-22-15-14-18(17-23(22)32-4)25-24(26(31)33-7-3)20(11-6-2)29-27-28-19-12-9-10-13-21(19)30(25)27/h9-10,12-15,17,25H,5-8,11,16H2,1-4H3,(H,28,29)