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

Systemtic Name: ethyl 4-[3-[(4-bromanylphenoxy)methyl]-2,5-dimethyl-phenyl]-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[3-[(4-bromophenoxy)methyl]-2,5-dimethyl-phenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-[3-[(4-bromophenoxy)methyl]-2,5-dimethylphenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-[(4-bromophenoxy)methyl]-2,5-dimethylphenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-[3-[(4-bromophenoxy)methyl]-2,5-dimethyl-phenyl]-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C23H25BrN2O4 MolecularWeight: 473.3596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC(=CC(=C2C)COC3=CC=C(C=C3)Br)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C2=CC(=CC(=C2C)COC3=CC=C(C=C3)Br)C)C

InChI

InChI=1S/C23H25BrN2O4/c1-5-29-22(27)20-15(4)25-23(28)26-21(20)19-11-13(2)10-16(14(19)3)12-30-18-8-6-17(24)7-9-18/h6-11,21H,5,12H2,1-4H3,(H2,25,26,28)