6-(azepan-1-yl)-3-methyl-5-[[3-(trifluoromethyl)phenyl]methyl]-1H-pyrimidine-2,4-dione

Systemtic Name: 6-(azepan-1-yl)-3-methyl-5-[[3-(trifluoromethyl)phenyl]methyl]-1H-pyrimidine-2,4-dione Openeye Name: 6-(azepan-1-yl)-3-methyl-5-[[3-(trifluoromethyl)phenyl]methyl]-1H-pyrimidine-2,4-dione CAS Name: 6-(1-azepanyl)-3-methyl-5-[[3-(trifluoromethyl)phenyl]methyl]-1H-pyrimidine-2,4-dione IUPAC Name: 6-(azepan-1-yl)-3-methyl-5-[[3-(trifluoromethyl)phenyl]methyl]-1H-pyrimidine-2,4-dione Traditional Name: 6-(azepan-1-yl)-3-methyl-5-[3-(trifluoromethyl)benzyl]uracil Formula: C19H22F3N3O2 MolecularWeight: 381.39209

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C(NC1=O)N2CCCCCC2)CC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

CN1C(=O)C(=C(NC1=O)N2CCCCCC2)CC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C19H22F3N3O2/c1-24-17(26)15(12-13-7-6-8-14(11-13)19(20,21)22)16(23-18(24)27)25-9-4-2-3-5-10-25/h6-8,11H,2-5,9-10,12H2,1H3,(H,23,27)