(4S)-4-(4-butoxyphenyl)-2-methyl-N-phenyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxamide

Systemtic Name: (4S)-4-(4-butoxyphenyl)-2-methyl-N-phenyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxamide Openeye Name: (4S)-4-(4-butoxyphenyl)-2-methyl-N-phenyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxamide CAS Name: (4S)-4-(4-butoxyphenyl)-2-methyl-N-phenyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxamide IUPAC Name: (4S)-4-(4-butoxyphenyl)-2-methyl-N-phenyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxamide Traditional Name: (4S)-4-(4-butoxyphenyl)-2-methyl-N-phenyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxamide Formula: C28H28N4O2 MolecularWeight: 452.54752

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2C(=C(NC3=NC4=CC=CC=C4N23)C)C(=O)NC5=CC=CC=C5

Isomeric SMILES

CCCCOC1=CC=C(C=C1)[C@H]2C(=C(NC3=NC4=CC=CC=C4N23)C)C(=O)NC5=CC=CC=C5

InChI

InChI=1S/C28H28N4O2/c1-3-4-18-34-22-16-14-20(15-17-22)26-25(27(33)30-21-10-6-5-7-11-21)19(2)29-28-31-23-12-8-9-13-24(23)32(26)28/h5-17,26H,3-4,18H2,1-2H3,(H,29,31)(H,30,33)/t26-/m0/s1