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

Systemtic Name: 1-methyl-3-[3-(5-methyl-2-propan-2-yloxy-phenyl)-1,2-benzothiazol-5-yl]-6-(trifluoromethyl)pyrimidine-2,4-dione Openeye Name: 3-[3-(2-isopropoxy-5-methyl-phenyl)-1,2-benzothiazol-5-yl]-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione CAS Name: 1-methyl-3-[3-(5-methyl-2-propan-2-yloxyphenyl)-1,2-benzothiazol-5-yl]-6-(trifluoromethyl)pyrimidine-2,4-dione IUPAC Name: 1-methyl-3-[3-(5-methyl-2-propan-2-yloxyphenyl)-1,2-benzothiazol-5-yl]-6-(trifluoromethyl)pyrimidine-2,4-dione Traditional Name: 3-[3-(2-isopropoxy-5-methyl-phenyl)-1,2-benzothiazol-5-yl]-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-quinone Formula: C23H20F3N3O3S MolecularWeight: 475.48341

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(C)C)C2=NSC3=C2C=C(C=C3)N4C(=O)C=C(N(C4=O)C)C(F)(F)F

Isomeric SMILES

CC1=CC(=C(C=C1)OC(C)C)C2=NSC3=C2C=C(C=C3)N4C(=O)C=C(N(C4=O)C)C(F)(F)F

InChI

InChI=1S/C23H20F3N3O3S/c1-12(2)32-17-7-5-13(3)9-15(17)21-16-10-14(6-8-18(16)33-27-21)29-20(30)11-19(23(24,25)26)28(4)22(29)31/h5-12H,1-4H3