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

Systemtic Name: ethyl 6-(4-tert-butylphenyl)-4-[[cyclohexyl(methyl)amino]methyl]-3-ethyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 6-(4-tert-butylphenyl)-4-[[cyclohexyl(methyl)amino]methyl]-3-ethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-(4-tert-butylphenyl)-4-[[cyclohexyl(methyl)amino]methyl]-3-ethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(4-tert-butylphenyl)-4-[[cyclohexyl(methyl)amino]methyl]-3-ethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-(4-tert-butylphenyl)-4-[[cyclohexyl(methyl)amino]methyl]-3-ethyl-2-keto-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C27H41N3O3 MolecularWeight: 455.63274

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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)CN(C)C3CCCCC3

Isomeric SMILES

CCN1C(=C(C(NC1=O)C2=CC=C(C=C2)C(C)(C)C)C(=O)OCC)CN(C)C3CCCCC3

InChI

InChI=1S/C27H41N3O3/c1-7-30-22(18-29(6)21-12-10-9-11-13-21)23(25(31)33-8-2)24(28-26(30)32)19-14-16-20(17-15-19)27(3,4)5/h14-17,21,24H,7-13,18H2,1-6H3,(H,28,32)