ethyl 4-[3-ethoxy-4-(3-methylbutoxy)phenyl]-2-propyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate

Systemtic Name: ethyl 4-[3-ethoxy-4-(3-methylbutoxy)phenyl]-2-propyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Openeye Name: ethyl 4-(3-ethoxy-4-isopentyloxy-phenyl)-2-propyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate CAS Name: 4-[3-ethoxy-4-(3-methylbutoxy)phenyl]-2-propyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-ethoxy-4-(3-methylbutoxy)phenyl]-2-propyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Traditional Name: 4-(3-ethoxy-4-isoamoxy-phenyl)-2-propyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylic acid ethyl ester Formula: C29H37N3O4 MolecularWeight: 491.62178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H37N3O4/c1-6-11-22-26(28(33)35-8-3)27(32-23-13-10-9-12-21(23)30-29(32)31-22)20-14-15-24(25(18-20)34-7-2)36-17-16-19(4)5/h9-10,12-15,18-19,27H,6-8,11,16-17H2,1-5H3,(H,30,31)