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

Systemtic Name: 3-[3-(hydroxymethyl)-1,2-benzothiazol-5-yl]-6-(trifluoromethyl)-1H-pyrimidine-2,4-dione Openeye Name: 3-[3-(hydroxymethyl)-1,2-benzothiazol-5-yl]-6-(trifluoromethyl)-1H-pyrimidine-2,4-dione CAS Name: 3-[3-(hydroxymethyl)-1,2-benzothiazol-5-yl]-6-(trifluoromethyl)-1H-pyrimidine-2,4-dione IUPAC Name: 3-[3-(hydroxymethyl)-1,2-benzothiazol-5-yl]-6-(trifluoromethyl)-1H-pyrimidine-2,4-dione Traditional Name: 3-(3-methylol-1,2-benzothiazol-5-yl)-6-(trifluoromethyl)uracil Formula: C13H8F3N3O3S MolecularWeight: 343.28113

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1N3C(=O)C=C(NC3=O)C(F)(F)F)C(=NS2)CO

Isomeric SMILES

C1=CC2=C(C=C1N3C(=O)C=C(NC3=O)C(F)(F)F)C(=NS2)CO

InChI

InChI=1S/C13H8F3N3O3S/c14-13(15,16)10-4-11(21)19(12(22)17-10)6-1-2-9-7(3-6)8(5-20)18-23-9/h1-4,20H,5H2,(H,17,22)