6-(3,5-dimethylphenyl)carbonyl-5-ethyl-1-(pyridin-4-ylmethyl)pyrimidine-2,4-dione

Systemtic Name: 6-(3,5-dimethylphenyl)carbonyl-5-ethyl-1-(pyridin-4-ylmethyl)pyrimidine-2,4-dione Openeye Name: 6-(3,5-dimethylbenzoyl)-5-ethyl-1-(4-pyridylmethyl)pyrimidine-2,4-dione CAS Name: 6-[(3,5-dimethylphenyl)-oxomethyl]-5-ethyl-1-(pyridin-4-ylmethyl)pyrimidine-2,4-dione IUPAC Name: 6-(3,5-dimethylbenzoyl)-5-ethyl-1-(pyridin-4-ylmethyl)pyrimidine-2,4-dione Traditional Name: 6-(3,5-dimethylbenzoyl)-5-ethyl-1-(4-pyridylmethyl)pyrimidine-2,4-quinone Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(C(=O)NC1=O)CC2=CC=NC=C2)C(=O)C3=CC(=CC(=C3)C)C

Isomeric SMILES

CCC1=C(N(C(=O)NC1=O)CC2=CC=NC=C2)C(=O)C3=CC(=CC(=C3)C)C

InChI

InChI=1S/C21H21N3O3/c1-4-17-18(19(25)16-10-13(2)9-14(3)11-16)24(21(27)23-20(17)26)12-15-5-7-22-8-6-15/h5-11H,4,12H2,1-3H3,(H,23,26,27)