prop-2-enyl 2-methyl-4-[3-(3-methylbutoxy)phenyl]-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate

Systemtic Name: prop-2-enyl 2-methyl-4-[3-(3-methylbutoxy)phenyl]-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Openeye Name: allyl 4-(3-isopentyloxyphenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate CAS Name: 2-methyl-4-[3-(3-methylbutoxy)phenyl]-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 2-methyl-4-[3-(3-methylbutoxy)phenyl]-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Traditional Name: 4-(3-isoamoxyphenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylic acid allyl ester Formula: C26H29N3O3 MolecularWeight: 431.52676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N2C3=CC=CC=C3N=C2N1)C4=CC(=CC=C4)OCCC(C)C)C(=O)OCC=C

Isomeric SMILES

CC1=C(C(N2C3=CC=CC=C3N=C2N1)C4=CC(=CC=C4)OCCC(C)C)C(=O)OCC=C

InChI

InChI=1S/C26H29N3O3/c1-5-14-32-25(30)23-18(4)27-26-28-21-11-6-7-12-22(21)29(26)24(23)19-9-8-10-20(16-19)31-15-13-17(2)3/h5-12,16-17,24H,1,13-15H2,2-4H3,(H,27,28)