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

Systemtic Name: ethyl 6-(4-tert-butylphenyl)-4-[[methyl(propyl)amino]methyl]-2-oxidanylidene-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-allyl-6-(4-tert-butylphenyl)-4-[[methyl(propyl)amino]methyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-(4-tert-butylphenyl)-4-[[methyl(propyl)amino]methyl]-2-oxo-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(4-tert-butylphenyl)-4-[[methyl(propyl)amino]methyl]-2-oxo-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-allyl-6-(4-tert-butylphenyl)-2-keto-4-[[methyl(propyl)amino]methyl]-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C25H37N3O3 MolecularWeight: 427.57958

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C)CC1=C(C(NC(=O)N1CC=C)C2=CC=C(C=C2)C(C)(C)C)C(=O)OCC

Isomeric SMILES

CCCN(C)CC1=C(C(NC(=O)N1CC=C)C2=CC=C(C=C2)C(C)(C)C)C(=O)OCC

InChI

InChI=1S/C25H37N3O3/c1-8-15-27(7)17-20-21(23(29)31-10-3)22(26-24(30)28(20)16-9-2)18-11-13-19(14-12-18)25(4,5)6/h9,11-14,22H,2,8,10,15-17H2,1,3-7H3,(H,26,30)