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

Systemtic Name: ethyl 6-(4-tert-butylphenyl)-4-[(4-ethoxycarbonylpiperidin-1-yl)methyl]-3-methyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 6-(4-tert-butylphenyl)-4-[(4-ethoxycarbonyl-1-piperidyl)methyl]-3-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-(4-tert-butylphenyl)-4-[(4-ethoxycarbonyl-1-piperidinyl)methyl]-3-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(4-tert-butylphenyl)-4-[(4-ethoxycarbonylpiperidin-1-yl)methyl]-3-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-(4-tert-butylphenyl)-4-[(4-carbethoxypiperidino)methyl]-2-keto-3-methyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C27H39N3O5 MolecularWeight: 485.61566

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)CC2=C(C(NC(=O)N2C)C3=CC=C(C=C3)C(C)(C)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1CCN(CC1)CC2=C(C(NC(=O)N2C)C3=CC=C(C=C3)C(C)(C)C)C(=O)OCC

InChI

InChI=1S/C27H39N3O5/c1-7-34-24(31)19-13-15-30(16-14-19)17-21-22(25(32)35-8-2)23(28-26(33)29(21)6)18-9-11-20(12-10-18)27(3,4)5/h9-12,19,23H,7-8,13-17H2,1-6H3,(H,28,33)