[(4S)-4-(4-butoxyphenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazol-3-yl]-phenyl-methanone

Systemtic Name: [(4S)-4-(4-butoxyphenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazol-3-yl]-phenyl-methanone Openeye Name: [(4S)-4-(4-butoxyphenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazol-3-yl]-phenyl-methanone CAS Name: [(4S)-4-(4-butoxyphenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazol-3-yl]-phenylmethanone IUPAC Name: [(4S)-4-(4-butoxyphenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazol-3-yl]-phenylmethanone Traditional Name: [(4S)-4-(4-butoxyphenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazol-3-yl]-phenyl-methanone Formula: C28H27N3O2 MolecularWeight: 437.53288

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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)C5=CC=CC=C5

Isomeric SMILES

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

InChI

InChI=1S/C28H27N3O2/c1-3-4-18-33-22-16-14-20(15-17-22)26-25(27(32)21-10-6-5-7-11-21)19(2)29-28-30-23-12-8-9-13-24(23)31(26)28/h5-17,26H,3-4,18H2,1-2H3,(H,29,30)/t26-/m0/s1