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

Systemtic Name: ethyl 2-oxidanylidene-1-pentyl-4-(3-phenoxyphenyl)-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Openeye Name: ethyl 2-oxo-1-pentyl-4-(3-phenoxyphenyl)-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate CAS Name: 2-oxo-1-pentyl-4-(3-phenoxyphenyl)-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-oxo-1-pentyl-4-(3-phenoxyphenyl)-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Traditional Name: 1-amyl-2-keto-4-(3-phenoxyphenyl)-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylic acid ethyl ester Formula: C30H31N3O4 MolecularWeight: 497.58484

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C(C(N2C1=NC3=CC=CC=C32)C4=CC(=CC=C4)OC5=CC=CC=C5)C(=O)OCC

Isomeric SMILES

CCCCCN1C(=O)C(C(N2C1=NC3=CC=CC=C32)C4=CC(=CC=C4)OC5=CC=CC=C5)C(=O)OCC

InChI

InChI=1S/C30H31N3O4/c1-3-5-11-19-32-28(34)26(29(35)36-4-2)27(33-25-18-10-9-17-24(25)31-30(32)33)21-13-12-16-23(20-21)37-22-14-7-6-8-15-22/h6-10,12-18,20,26-27H,3-5,11,19H2,1-2H3