ethyl 6-(benzimidazol-1-ylmethyl)-4-(4-methylphenyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-(benzimidazol-1-ylmethyl)-4-(4-methylphenyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-(benzimidazol-1-ylmethyl)-2-oxo-4-(p-tolyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-(1-benzimidazolylmethyl)-4-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(benzimidazol-1-ylmethyl)-4-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-(benzimidazol-1-ylmethyl)-2-keto-4-(p-tolyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C22H22N4O3 MolecularWeight: 390.43508

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)C)CN3C=NC4=CC=CC=C43

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)C)CN3C=NC4=CC=CC=C43

InChI

InChI=1S/C22H22N4O3/c1-3-29-21(27)19-17(12-26-13-23-16-6-4-5-7-18(16)26)24-22(28)25-20(19)15-10-8-14(2)9-11-15/h4-11,13,20H,3,12H2,1-2H3,(H2,24,25,28)