5-bromanyl-3-methyl-1-(2-methylpropyl)-6-[oxidanyl-[2-(trifluoromethyl)phenyl]methyl]thieno[2,3-d]pyrimidine-2,4-dione

Systemtic Name: 5-bromanyl-3-methyl-1-(2-methylpropyl)-6-[oxidanyl-[2-(trifluoromethyl)phenyl]methyl]thieno[2,3-d]pyrimidine-2,4-dione Openeye Name: 5-bromo-6-[hydroxy-[2-(trifluoromethyl)phenyl]methyl]-1-isobutyl-3-methyl-thieno[2,3-d]pyrimidine-2,4-dione CAS Name: 5-bromo-6-[hydroxy-[2-(trifluoromethyl)phenyl]methyl]-3-methyl-1-(2-methylpropyl)thieno[2,3-d]pyrimidine-2,4-dione IUPAC Name: 5-bromo-6-[hydroxy-[2-(trifluoromethyl)phenyl]methyl]-3-methyl-1-(2-methylpropyl)thieno[2,3-d]pyrimidine-2,4-dione Traditional Name: 5-bromo-6-[hydroxy-[2-(trifluoromethyl)phenyl]methyl]-1-isobutyl-3-methyl-thieno[2,3-d]pyrimidine-2,4-quinone Formula: C19H18BrF3N2O3S MolecularWeight: 491.32203

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=C(C(=C(S2)C(C3=CC=CC=C3C(F)(F)F)O)Br)C(=O)N(C1=O)C

Isomeric SMILES

CC(C)CN1C2=C(C(=C(S2)C(C3=CC=CC=C3C(F)(F)F)O)Br)C(=O)N(C1=O)C

InChI

InChI=1S/C19H18BrF3N2O3S/c1-9(2)8-25-17-12(16(27)24(3)18(25)28)13(20)15(29-17)14(26)10-6-4-5-7-11(10)19(21,22)23/h4-7,9,14,26H,8H2,1-3H3