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

Systemtic Name: ethyl 3-(1,3-benzoxazol-5-ylcarbonylamino)-4-(4-chlorophenyl)-6-methyl-2-oxidanylidene-1,4-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-(1,3-benzoxazole-5-carbonylamino)-4-(4-chlorophenyl)-6-methyl-2-oxo-1,4-dihydropyrimidine-5-carboxylate CAS Name: 3-[[1,3-benzoxazol-5-yl(oxo)methyl]amino]-4-(4-chlorophenyl)-6-methyl-2-oxo-1,4-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(1,3-benzoxazole-5-carbonylamino)-4-(4-chlorophenyl)-6-methyl-2-oxo-1,4-dihydropyrimidine-5-carboxylate Traditional Name: 3-(1,3-benzoxazole-5-carbonylamino)-4-(4-chlorophenyl)-2-keto-6-methyl-1,4-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C22H19ClN4O5 MolecularWeight: 454.86306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H19ClN4O5/c1-3-31-21(29)18-12(2)25-22(30)27(19(18)13-4-7-15(23)8-5-13)26-20(28)14-6-9-17-16(10-14)24-11-32-17/h4-11,19H,3H2,1-2H3,(H,25,30)(H,26,28)