ethyl 6-(3-chlorophenyl)-3-ethyl-4-(morpholin-4-ylmethyl)-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 6-(3-chlorophenyl)-3-ethyl-4-(morpholin-4-ylmethyl)-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 6-(3-chlorophenyl)-3-ethyl-4-(morpholinomethyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-(3-chlorophenyl)-3-ethyl-4-(4-morpholinylmethyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(3-chlorophenyl)-3-ethyl-4-(morpholin-4-ylmethyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-(3-chlorophenyl)-3-ethyl-2-keto-4-(morpholinomethyl)-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C20H26ClN3O4 MolecularWeight: 407.89114

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(NC1=O)C2=CC(=CC=C2)Cl)C(=O)OCC)CN3CCOCC3

Isomeric SMILES

CCN1C(=C(C(NC1=O)C2=CC(=CC=C2)Cl)C(=O)OCC)CN3CCOCC3

InChI

InChI=1S/C20H26ClN3O4/c1-3-24-16(13-23-8-10-27-11-9-23)17(19(25)28-4-2)18(22-20(24)26)14-6-5-7-15(21)12-14/h5-7,12,18H,3-4,8-11,13H2,1-2H3,(H,22,26)