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

Systemtic Name: ethyl 4-(3-bromophenyl)-1-(3-methylbutyl)-2-oxidanylidene-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Openeye Name: ethyl 4-(3-bromophenyl)-1-isopentyl-2-oxo-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate CAS Name: 4-(3-bromophenyl)-1-(3-methylbutyl)-2-oxo-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-bromophenyl)-1-(3-methylbutyl)-2-oxo-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Traditional Name: 4-(3-bromophenyl)-1-isoamyl-2-keto-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylic acid ethyl ester Formula: C24H26BrN3O3 MolecularWeight: 484.38554

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(N2C3=CC=CC=C3N=C2N(C1=O)CCC(C)C)C4=CC(=CC=C4)Br

Isomeric SMILES

CCOC(=O)C1C(N2C3=CC=CC=C3N=C2N(C1=O)CCC(C)C)C4=CC(=CC=C4)Br

InChI

InChI=1S/C24H26BrN3O3/c1-4-31-23(30)20-21(16-8-7-9-17(25)14-16)28-19-11-6-5-10-18(19)26-24(28)27(22(20)29)13-12-15(2)3/h5-11,14-15,20-21H,4,12-13H2,1-3H3