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

Systemtic Name: ethyl 6-(4-tert-butylphenyl)-3-ethyl-4-[[methyl-(phenylmethyl)amino]methyl]-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 4-[[benzyl(methyl)amino]methyl]-6-(4-tert-butylphenyl)-3-ethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-(4-tert-butylphenyl)-3-ethyl-4-[[methyl-(phenylmethyl)amino]methyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[[benzyl(methyl)amino]methyl]-6-(4-tert-butylphenyl)-3-ethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 4-[[benzyl(methyl)amino]methyl]-6-(4-tert-butylphenyl)-3-ethyl-2-keto-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C28H37N3O3 MolecularWeight: 463.61168

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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)CC3=CC=CC=C3

Isomeric SMILES

CCN1C(=C(C(NC1=O)C2=CC=C(C=C2)C(C)(C)C)C(=O)OCC)CN(C)CC3=CC=CC=C3

InChI

InChI=1S/C28H37N3O3/c1-7-31-23(19-30(6)18-20-12-10-9-11-13-20)24(26(32)34-8-2)25(29-27(31)33)21-14-16-22(17-15-21)28(3,4)5/h9-17,25H,7-8,18-19H2,1-6H3,(H,29,33)