ethyl (4R)-4-(3-fluorophenyl)-2-propyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate

Systemtic Name: ethyl (4R)-4-(3-fluorophenyl)-2-propyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Openeye Name: ethyl (4R)-4-(3-fluorophenyl)-2-propyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate CAS Name: (4R)-4-(3-fluorophenyl)-2-propyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl (4R)-4-(3-fluorophenyl)-2-propyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Traditional Name: (4R)-4-(3-fluorophenyl)-2-propyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylic acid ethyl ester Formula: C22H22FN3O2 MolecularWeight: 379.427383

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(N2C3=CC=CC=C3N=C2N1)C4=CC(=CC=C4)F)C(=O)OCC

Isomeric SMILES

CCCC1=C([C@H](N2C3=CC=CC=C3N=C2N1)C4=CC(=CC=C4)F)C(=O)OCC

InChI

InChI=1S/C22H22FN3O2/c1-3-8-17-19(21(27)28-4-2)20(14-9-7-10-15(23)13-14)26-18-12-6-5-11-16(18)24-22(26)25-17/h5-7,9-13,20H,3-4,8H2,1-2H3,(H,24,25)/t20-/m1/s1