3-[3-(hydroxymethyl)-1,2-benzothiazol-5-yl]-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione

Systemtic Name: 3-[3-(hydroxymethyl)-1,2-benzothiazol-5-yl]-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione Openeye Name: 3-[3-(hydroxymethyl)-1,2-benzothiazol-5-yl]-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione CAS Name: 3-[3-(hydroxymethyl)-1,2-benzothiazol-5-yl]-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione IUPAC Name: 3-[3-(hydroxymethyl)-1,2-benzothiazol-5-yl]-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione Traditional Name: 1-methyl-3-(3-methylol-1,2-benzothiazol-5-yl)-6-(trifluoromethyl)pyrimidine-2,4-quinone Formula: C14H10F3N3O3S MolecularWeight: 357.30771

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=O)N(C1=O)C2=CC3=C(C=C2)SN=C3CO)C(F)(F)F

Isomeric SMILES

CN1C(=CC(=O)N(C1=O)C2=CC3=C(C=C2)SN=C3CO)C(F)(F)F

InChI

InChI=1S/C14H10F3N3O3S/c1-19-11(14(15,16)17)5-12(22)20(13(19)23)7-2-3-10-8(4-7)9(6-21)18-24-10/h2-5,21H,6H2,1H3