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

Systemtic Name: ethyl 4-(3-ethoxy-4-propoxy-phenyl)-2-propyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Openeye Name: ethyl 4-(3-ethoxy-4-propoxy-phenyl)-2-propyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate CAS Name: 4-(3-ethoxy-4-propoxyphenyl)-2-propyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-ethoxy-4-propoxyphenyl)-2-propyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Traditional Name: 4-(3-ethoxy-4-propoxy-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:

CCCC1=C(C(N2C3=CC=CC=C3N=C2N1)C4=CC(=C(C=C4)OCCC)OCC)C(=O)OCC

Isomeric SMILES

CCCC1=C(C(N2C3=CC=CC=C3N=C2N1)C4=CC(=C(C=C4)OCCC)OCC)C(=O)OCC

InChI

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