ethyl (3S,4R)-1-(2-methoxyethyl)-2-oxidanylidene-4-pyridin-4-yl-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate

Systemtic Name: ethyl (3S,4R)-1-(2-methoxyethyl)-2-oxidanylidene-4-pyridin-4-yl-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Openeye Name: ethyl (3S,4R)-1-(2-methoxyethyl)-2-oxo-4-(4-pyridyl)-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate CAS Name: (3S,4R)-1-(2-methoxyethyl)-2-oxo-4-pyridin-4-yl-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl (3S,4R)-1-(2-methoxyethyl)-2-oxo-4-pyridin-4-yl-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Traditional Name: (3S,4R)-2-keto-1-(2-methoxyethyl)-4-(4-pyridyl)-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylic acid ethyl ester Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(N2C3=CC=CC=C3N=C2N(C1=O)CCOC)C4=CC=NC=C4

Isomeric SMILES

CCOC(=O)[C@H]1[C@@H](N2C3=CC=CC=C3N=C2N(C1=O)CCOC)C4=CC=NC=C4

InChI

InChI=1S/C21H22N4O4/c1-3-29-20(27)17-18(14-8-10-22-11-9-14)25-16-7-5-4-6-15(16)23-21(25)24(19(17)26)12-13-28-2/h4-11,17-18H,3,12-13H2,1-2H3/t17-,18-/m0/s1