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

Systemtic Name: ethyl 6-(2,4-dichlorophenyl)-4-[(4-ethanoylpiperazin-1-yl)methyl]-3-ethyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 4-[(4-acetylpiperazin-1-yl)methyl]-6-(2,4-dichlorophenyl)-3-ethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 4-[(4-acetyl-1-piperazinyl)methyl]-6-(2,4-dichlorophenyl)-3-ethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-acetylpiperazin-1-yl)methyl]-6-(2,4-dichlorophenyl)-3-ethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 4-[(4-acetylpiperazino)methyl]-6-(2,4-dichlorophenyl)-3-ethyl-2-keto-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C22H28Cl2N4O4 MolecularWeight: 483.38812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(NC1=O)C2=C(C=C(C=C2)Cl)Cl)C(=O)OCC)CN3CCN(CC3)C(=O)C

Isomeric SMILES

CCN1C(=C(C(NC1=O)C2=C(C=C(C=C2)Cl)Cl)C(=O)OCC)CN3CCN(CC3)C(=O)C

InChI

InChI=1S/C22H28Cl2N4O4/c1-4-28-18(13-26-8-10-27(11-9-26)14(3)29)19(21(30)32-5-2)20(25-22(28)31)16-7-6-15(23)12-17(16)24/h6-7,12,20H,4-5,8-11,13H2,1-3H3,(H,25,31)