1-(4-chloranylbutyl)-5-(2-methylpyridin-3-yl)-3-(phenylcarbonyl)pyrimidine-2,4-dione

Systemtic Name: 1-(4-chloranylbutyl)-5-(2-methylpyridin-3-yl)-3-(phenylcarbonyl)pyrimidine-2,4-dione Openeye Name: 3-benzoyl-1-(4-chlorobutyl)-5-(2-methyl-3-pyridyl)pyrimidine-2,4-dione CAS Name: 3-benzoyl-1-(4-chlorobutyl)-5-(2-methyl-3-pyridinyl)pyrimidine-2,4-dione IUPAC Name: 3-benzoyl-1-(4-chlorobutyl)-5-(2-methylpyridin-3-yl)pyrimidine-2,4-dione Traditional Name: 3-benzoyl-1-(4-chlorobutyl)-5-(2-methyl-3-pyridyl)pyrimidine-2,4-quinone Formula: C21H20ClN3O3 MolecularWeight: 397.8548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=N1)C2=CN(C(=O)N(C2=O)C(=O)C3=CC=CC=C3)CCCCCl

Isomeric SMILES

CC1=C(C=CC=N1)C2=CN(C(=O)N(C2=O)C(=O)C3=CC=CC=C3)CCCCCl

InChI

InChI=1S/C21H20ClN3O3/c1-15-17(10-7-12-23-15)18-14-24(13-6-5-11-22)21(28)25(20(18)27)19(26)16-8-3-2-4-9-16/h2-4,7-10,12,14H,5-6,11,13H2,1H3