methyl 4-[2-methyl-3-(phenylcarbonyl)-1,4-dihydropyrimido[1,2-a]benzimidazol-4-yl]benzoate

Systemtic Name: methyl 4-[2-methyl-3-(phenylcarbonyl)-1,4-dihydropyrimido[1,2-a]benzimidazol-4-yl]benzoate Openeye Name: methyl 4-(3-benzoyl-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazol-4-yl)benzoate CAS Name: 4-(3-benzoyl-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazol-4-yl)benzoic acid methyl ester IUPAC Name: methyl 4-(3-benzoyl-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazol-4-yl)benzoate Traditional Name: 4-(3-benzoyl-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazol-4-yl)benzoic acid methyl ester Formula: C26H21N3O3 MolecularWeight: 423.46324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N2C3=CC=CC=C3N=C2N1)C4=CC=C(C=C4)C(=O)OC)C(=O)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C(N2C3=CC=CC=C3N=C2N1)C4=CC=C(C=C4)C(=O)OC)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C26H21N3O3/c1-16-22(24(30)18-8-4-3-5-9-18)23(17-12-14-19(15-13-17)25(31)32-2)29-21-11-7-6-10-20(21)28-26(29)27-16/h3-15,23H,1-2H3,(H,27,28)