propan-2-yl 4-(4-butoxy-3-ethoxy-phenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate

Systemtic Name: propan-2-yl 4-(4-butoxy-3-ethoxy-phenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Openeye Name: isopropyl 4-(4-butoxy-3-ethoxy-phenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate CAS Name: 4-(4-butoxy-3-ethoxyphenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-(4-butoxy-3-ethoxyphenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Traditional Name: 4-(4-butoxy-3-ethoxy-phenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylic acid isopropyl 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)C)C(=O)OC(C)C)OCC

Isomeric SMILES

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

InChI

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