ethyl 4-(3-butoxyphenyl)-2-phenyl-4,10-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate

Systemtic Name: ethyl 4-(3-butoxyphenyl)-2-phenyl-4,10-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Openeye Name: ethyl 4-(3-butoxyphenyl)-2-phenyl-4,10-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate CAS Name: 4-(3-butoxyphenyl)-2-phenyl-4,10-dihydropyrimido[1,2-a]benzimidazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-butoxyphenyl)-2-phenyl-4,10-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Traditional Name: 4-(3-butoxyphenyl)-2-phenyl-4,10-dihydropyrimido[1,2-a]benzimidazole-3-carboxylic acid ethyl ester Formula: C29H29N3O3 MolecularWeight: 467.55886

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C2C(=C(N=C3N2C4=CC=CC=C4N3)C5=CC=CC=C5)C(=O)OCC

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C2C(=C(N=C3N2C4=CC=CC=C4N3)C5=CC=CC=C5)C(=O)OCC

InChI

InChI=1S/C29H29N3O3/c1-3-5-18-35-22-15-11-14-21(19-22)27-25(28(33)34-4-2)26(20-12-7-6-8-13-20)31-29-30-23-16-9-10-17-24(23)32(27)29/h6-17,19,27H,3-5,18H2,1-2H3,(H,30,31)