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

Systemtic Name: 1-methyl-3-[3-(4-methylthiophen-3-yl)-1,2-benzothiazol-5-yl]-6-(trifluoromethyl)pyrimidine-2,4-dione Openeye Name: 1-methyl-3-[3-(4-methyl-3-thienyl)-1,2-benzothiazol-5-yl]-6-(trifluoromethyl)pyrimidine-2,4-dione CAS Name: 1-methyl-3-[3-(4-methyl-3-thiophenyl)-1,2-benzothiazol-5-yl]-6-(trifluoromethyl)pyrimidine-2,4-dione IUPAC Name: 1-methyl-3-[3-(4-methylthiophen-3-yl)-1,2-benzothiazol-5-yl]-6-(trifluoromethyl)pyrimidine-2,4-dione Traditional Name: 1-methyl-3-[3-(4-methyl-3-thienyl)-1,2-benzothiazol-5-yl]-6-(trifluoromethyl)pyrimidine-2,4-quinone Formula: C18H12F3N3O2S2 MolecularWeight: 423.43199

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC=C1C2=NSC3=C2C=C(C=C3)N4C(=O)C=C(N(C4=O)C)C(F)(F)F

Isomeric SMILES

CC1=CSC=C1C2=NSC3=C2C=C(C=C3)N4C(=O)C=C(N(C4=O)C)C(F)(F)F

InChI

InChI=1S/C18H12F3N3O2S2/c1-9-7-27-8-12(9)16-11-5-10(3-4-13(11)28-22-16)24-15(25)6-14(18(19,20)21)23(2)17(24)26/h3-8H,1-2H3