ethyl 6-[[(2-chloranyl-6-fluoranyl-phenyl)methyl-methyl-amino]methyl]-2-oxidanylidene-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[[(2-chloranyl-6-fluoranyl-phenyl)methyl-methyl-amino]methyl]-2-oxidanylidene-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[[(2-chloro-6-fluoro-phenyl)methyl-methyl-amino]methyl]-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[(2-chloro-6-fluorophenyl)methyl-methylamino]methyl]-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[[(2-chloro-6-fluorophenyl)methyl-methylamino]methyl]-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[[(2-chloro-6-fluoro-benzyl)-methyl-amino]methyl]-2-keto-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C22H23ClFN3O3 MolecularWeight: 431.887723

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2)CN(C)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2)CN(C)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C22H23ClFN3O3/c1-3-30-21(28)19-18(13-27(2)12-15-16(23)10-7-11-17(15)24)25-22(29)26-20(19)14-8-5-4-6-9-14/h4-11,20H,3,12-13H2,1-2H3,(H2,25,26,29)