ethyl 6-(4-tert-butylphenyl)-3-ethyl-4-[(2-methylpiperidin-1-yl)methyl]-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 6-(4-tert-butylphenyl)-3-ethyl-4-[(2-methylpiperidin-1-yl)methyl]-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 6-(4-tert-butylphenyl)-3-ethyl-4-[(2-methyl-1-piperidyl)methyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-(4-tert-butylphenyl)-3-ethyl-4-[(2-methyl-1-piperidinyl)methyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(4-tert-butylphenyl)-3-ethyl-4-[(2-methylpiperidin-1-yl)methyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-(4-tert-butylphenyl)-3-ethyl-2-keto-4-[(2-methylpiperidino)methyl]-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C26H39N3O3 MolecularWeight: 441.60616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(NC1=O)C2=CC=C(C=C2)C(C)(C)C)C(=O)OCC)CN3CCCCC3C

Isomeric SMILES

CCN1C(=C(C(NC1=O)C2=CC=C(C=C2)C(C)(C)C)C(=O)OCC)CN3CCCCC3C

InChI

InChI=1S/C26H39N3O3/c1-7-29-21(17-28-16-10-9-11-18(28)3)22(24(30)32-8-2)23(27-25(29)31)19-12-14-20(15-13-19)26(4,5)6/h12-15,18,23H,7-11,16-17H2,1-6H3,(H,27,31)