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

Systemtic Name: ethyl 6-(4-tert-butylphenyl)-4-[(4-ethoxycarbonylpiperidin-1-yl)methyl]-3-ethyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 6-(4-tert-butylphenyl)-4-[(4-ethoxycarbonyl-1-piperidyl)methyl]-3-ethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-(4-tert-butylphenyl)-4-[(4-ethoxycarbonyl-1-piperidinyl)methyl]-3-ethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(4-tert-butylphenyl)-4-[(4-ethoxycarbonylpiperidin-1-yl)methyl]-3-ethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-(4-tert-butylphenyl)-4-[(4-carbethoxypiperidino)methyl]-3-ethyl-2-keto-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C28H41N3O5 MolecularWeight: 499.64224

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H41N3O5/c1-7-31-22(18-30-16-14-20(15-17-30)25(32)35-8-2)23(26(33)36-9-3)24(29-27(31)34)19-10-12-21(13-11-19)28(4,5)6/h10-13,20,24H,7-9,14-18H2,1-6H3,(H,29,34)