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

Systemtic Name: ethyl 6-(3-chlorophenyl)-3-ethyl-4-[(4-ethylpiperazin-1-yl)methyl]-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 6-(3-chlorophenyl)-3-ethyl-4-[(4-ethylpiperazin-1-yl)methyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-(3-chlorophenyl)-3-ethyl-4-[(4-ethyl-1-piperazinyl)methyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(3-chlorophenyl)-3-ethyl-4-[(4-ethylpiperazin-1-yl)methyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-(3-chlorophenyl)-3-ethyl-4-[(4-ethylpiperazino)methyl]-2-keto-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C22H31ClN4O3 MolecularWeight: 434.95954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CC2=C(C(NC(=O)N2CC)C3=CC(=CC=C3)Cl)C(=O)OCC

Isomeric SMILES

CCN1CCN(CC1)CC2=C(C(NC(=O)N2CC)C3=CC(=CC=C3)Cl)C(=O)OCC

InChI

InChI=1S/C22H31ClN4O3/c1-4-25-10-12-26(13-11-25)15-18-19(21(28)30-6-3)20(24-22(29)27(18)5-2)16-8-7-9-17(23)14-16/h7-9,14,20H,4-6,10-13,15H2,1-3H3,(H,24,29)