ethyl 3-(1,3-benzoxazol-5-ylcarbonylamino)-6-methyl-2-oxidanylidene-4-phenyl-1,4-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 3-(1,3-benzoxazol-5-ylcarbonylamino)-6-methyl-2-oxidanylidene-4-phenyl-1,4-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-(1,3-benzoxazole-5-carbonylamino)-6-methyl-2-oxo-4-phenyl-1,4-dihydropyrimidine-5-carboxylate CAS Name: 3-[[1,3-benzoxazol-5-yl(oxo)methyl]amino]-6-methyl-2-oxo-4-phenyl-1,4-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(1,3-benzoxazole-5-carbonylamino)-6-methyl-2-oxo-4-phenyl-1,4-dihydropyrimidine-5-carboxylate Traditional Name: 3-(1,3-benzoxazole-5-carbonylamino)-2-keto-6-methyl-4-phenyl-1,4-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C22H20N4O5 MolecularWeight: 420.418

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)N(C1C2=CC=CC=C2)NC(=O)C3=CC4=C(C=C3)OC=N4)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N(C1C2=CC=CC=C2)NC(=O)C3=CC4=C(C=C3)OC=N4)C

InChI

InChI=1S/C22H20N4O5/c1-3-30-21(28)18-13(2)24-22(29)26(19(18)14-7-5-4-6-8-14)25-20(27)15-9-10-17-16(11-15)23-12-31-17/h4-12,19H,3H2,1-2H3,(H,24,29)(H,25,27)