ethyl 4-(diethylaminomethyl)-6-(3,4-dimethoxyphenyl)-3-methyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(diethylaminomethyl)-6-(3,4-dimethoxyphenyl)-3-methyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 4-(diethylaminomethyl)-6-(3,4-dimethoxyphenyl)-3-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 4-(diethylaminomethyl)-6-(3,4-dimethoxyphenyl)-3-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(diethylaminomethyl)-6-(3,4-dimethoxyphenyl)-3-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 4-(diethylaminomethyl)-6-(3,4-dimethoxyphenyl)-2-keto-3-methyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C21H31N3O5 MolecularWeight: 405.48794

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=C(C(NC(=O)N1C)C2=CC(=C(C=C2)OC)OC)C(=O)OCC

Isomeric SMILES

CCN(CC)CC1=C(C(NC(=O)N1C)C2=CC(=C(C=C2)OC)OC)C(=O)OCC

InChI

InChI=1S/C21H31N3O5/c1-7-24(8-2)13-15-18(20(25)29-9-3)19(22-21(26)23(15)4)14-10-11-16(27-5)17(12-14)28-6/h10-12,19H,7-9,13H2,1-6H3,(H,22,26)