6-[3,5-bis(trifluoromethyl)phenyl]carbonyl-5-ethyl-1-(pyridin-4-ylmethyl)pyrimidine-2,4-dione

Systemtic Name: 6-[3,5-bis(trifluoromethyl)phenyl]carbonyl-5-ethyl-1-(pyridin-4-ylmethyl)pyrimidine-2,4-dione Openeye Name: 6-[3,5-bis(trifluoromethyl)benzoyl]-5-ethyl-1-(4-pyridylmethyl)pyrimidine-2,4-dione CAS Name: 6-[[3,5-bis(trifluoromethyl)phenyl]-oxomethyl]-5-ethyl-1-(pyridin-4-ylmethyl)pyrimidine-2,4-dione IUPAC Name: 6-[3,5-bis(trifluoromethyl)benzoyl]-5-ethyl-1-(pyridin-4-ylmethyl)pyrimidine-2,4-dione Traditional Name: 6-[3,5-bis(trifluoromethyl)benzoyl]-5-ethyl-1-(4-pyridylmethyl)pyrimidine-2,4-quinone Formula: C21H15F6N3O3 MolecularWeight: 471.352519

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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(F)(F)F)C(F)(F)F

Isomeric SMILES

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

InChI

InChI=1S/C21H15F6N3O3/c1-2-15-16(30(19(33)29-18(15)32)10-11-3-5-28-6-4-11)17(31)12-7-13(20(22,23)24)9-14(8-12)21(25,26)27/h3-9H,2,10H2,1H3,(H,29,32,33)