ethyl 4-[(3-ethoxycarbonylpiperidin-1-yl)methyl]-3-ethyl-6-(2-fluorophenyl)-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[(3-ethoxycarbonylpiperidin-1-yl)methyl]-3-ethyl-6-(2-fluorophenyl)-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 4-[(3-ethoxycarbonyl-1-piperidyl)methyl]-3-ethyl-6-(2-fluorophenyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 4-[(3-ethoxycarbonyl-1-piperidinyl)methyl]-3-ethyl-6-(2-fluorophenyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[(3-ethoxycarbonylpiperidin-1-yl)methyl]-3-ethyl-6-(2-fluorophenyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 4-[(3-carbethoxypiperidino)methyl]-3-ethyl-6-(2-fluorophenyl)-2-keto-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C24H32FN3O5 MolecularWeight: 461.526383

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(NC1=O)C2=CC=CC=C2F)C(=O)OCC)CN3CCCC(C3)C(=O)OCC

Isomeric SMILES

CCN1C(=C(C(NC1=O)C2=CC=CC=C2F)C(=O)OCC)CN3CCCC(C3)C(=O)OCC

InChI

InChI=1S/C24H32FN3O5/c1-4-28-19(15-27-13-9-10-16(14-27)22(29)32-5-2)20(23(30)33-6-3)21(26-24(28)31)17-11-7-8-12-18(17)25/h7-8,11-12,16,21H,4-6,9-10,13-15H2,1-3H3,(H,26,31)