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

Systemtic Name: ethyl 3-ethyl-6-(3-methylphenyl)-4-[(4-methylpiperidin-1-yl)methyl]-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-ethyl-4-[(4-methyl-1-piperidyl)methyl]-6-(m-tolyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-ethyl-6-(3-methylphenyl)-4-[(4-methyl-1-piperidinyl)methyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-ethyl-6-(3-methylphenyl)-4-[(4-methylpiperidin-1-yl)methyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-ethyl-2-keto-4-[(4-methylpiperidino)methyl]-6-(m-tolyl)-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C23H33N3O3 MolecularWeight: 399.52642

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(NC1=O)C2=CC(=CC=C2)C)C(=O)OCC)CN3CCC(CC3)C

Isomeric SMILES

CCN1C(=C(C(NC1=O)C2=CC(=CC=C2)C)C(=O)OCC)CN3CCC(CC3)C

InChI

InChI=1S/C23H33N3O3/c1-5-26-19(15-25-12-10-16(3)11-13-25)20(22(27)29-6-2)21(24-23(26)28)18-9-7-8-17(4)14-18/h7-9,14,16,21H,5-6,10-13,15H2,1-4H3,(H,24,28)