ethyl 2-oxidanylidene-1-pentyl-4-(4-propoxyphenyl)-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate

Systemtic Name: ethyl 2-oxidanylidene-1-pentyl-4-(4-propoxyphenyl)-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Openeye Name: ethyl 2-oxo-1-pentyl-4-(4-propoxyphenyl)-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate CAS Name: 2-oxo-1-pentyl-4-(4-propoxyphenyl)-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-oxo-1-pentyl-4-(4-propoxyphenyl)-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Traditional Name: 1-amyl-2-keto-4-(4-propoxyphenyl)-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylic acid ethyl ester Formula: C27H33N3O4 MolecularWeight: 463.56862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C(C(N2C1=NC3=CC=CC=C32)C4=CC=C(C=C4)OCCC)C(=O)OCC

Isomeric SMILES

CCCCCN1C(=O)C(C(N2C1=NC3=CC=CC=C32)C4=CC=C(C=C4)OCCC)C(=O)OCC

InChI

InChI=1S/C27H33N3O4/c1-4-7-10-17-29-25(31)23(26(32)33-6-3)24(19-13-15-20(16-14-19)34-18-5-2)30-22-12-9-8-11-21(22)28-27(29)30/h8-9,11-16,23-24H,4-7,10,17-18H2,1-3H3