butyl (4S)-4-(4-ethoxyphenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate

Systemtic Name: butyl (4S)-4-(4-ethoxyphenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Openeye Name: butyl (4S)-4-(4-ethoxyphenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate CAS Name: (4S)-4-(4-ethoxyphenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylic acid butyl ester IUPAC Name: butyl (4S)-4-(4-ethoxyphenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Traditional Name: (4S)-2-methyl-4-p-phenetyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylic acid butyl ester Formula: C24H27N3O3 MolecularWeight: 405.48948

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(NC2=NC3=CC=CC=C3N2C1C4=CC=C(C=C4)OCC)C

Isomeric SMILES

CCCCOC(=O)C1=C(NC2=NC3=CC=CC=C3N2[C@H]1C4=CC=C(C=C4)OCC)C

InChI

InChI=1S/C24H27N3O3/c1-4-6-15-30-23(28)21-16(3)25-24-26-19-9-7-8-10-20(19)27(24)22(21)17-11-13-18(14-12-17)29-5-2/h7-14,22H,4-6,15H2,1-3H3,(H,25,26)/t22-/m0/s1