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

Systemtic Name: 3-[3-(3-methoxythiophen-2-yl)-1,2-benzothiazol-5-yl]-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione Openeye Name: 3-[3-(3-methoxy-2-thienyl)-1,2-benzothiazol-5-yl]-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione CAS Name: 3-[3-(3-methoxy-2-thiophenyl)-1,2-benzothiazol-5-yl]-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione IUPAC Name: 3-[3-(3-methoxythiophen-2-yl)-1,2-benzothiazol-5-yl]-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione Traditional Name: 3-[3-(3-methoxy-2-thienyl)-1,2-benzothiazol-5-yl]-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-quinone Formula: C18H12F3N3O3S2 MolecularWeight: 439.43139

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=O)N(C1=O)C2=CC3=C(C=C2)SN=C3C4=C(C=CS4)OC)C(F)(F)F

Isomeric SMILES

CN1C(=CC(=O)N(C1=O)C2=CC3=C(C=C2)SN=C3C4=C(C=CS4)OC)C(F)(F)F

InChI

InChI=1S/C18H12F3N3O3S2/c1-23-13(18(19,20)21)8-14(25)24(17(23)26)9-3-4-12-10(7-9)15(22-29-12)16-11(27-2)5-6-28-16/h3-8H,1-2H3