ethyl 1-butyl-4-naphthalen-1-yl-2-oxidanylidene-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate

Systemtic Name: ethyl 1-butyl-4-naphthalen-1-yl-2-oxidanylidene-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Openeye Name: ethyl 1-butyl-4-(1-naphthyl)-2-oxo-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate CAS Name: 1-butyl-4-(1-naphthalenyl)-2-oxo-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 1-butyl-4-naphthalen-1-yl-2-oxo-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Traditional Name: 1-butyl-2-keto-4-(1-naphthyl)-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylic acid ethyl ester Formula: C27H27N3O3 MolecularWeight: 441.52158

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(C(N2C1=NC3=CC=CC=C32)C4=CC=CC5=CC=CC=C54)C(=O)OCC

Isomeric SMILES

CCCCN1C(=O)C(C(N2C1=NC3=CC=CC=C32)C4=CC=CC5=CC=CC=C54)C(=O)OCC

InChI

InChI=1S/C27H27N3O3/c1-3-5-17-29-25(31)23(26(32)33-4-2)24(20-14-10-12-18-11-6-7-13-19(18)20)30-22-16-9-8-15-21(22)28-27(29)30/h6-16,23-24H,3-5,17H2,1-2H3