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

Systemtic Name: 1-methyl-3-(3-thiophen-3-yl-1,2-benzothiazol-5-yl)-6-(trifluoromethyl)pyrimidine-2,4-dione Openeye Name: 1-methyl-3-[3-(3-thienyl)-1,2-benzothiazol-5-yl]-6-(trifluoromethyl)pyrimidine-2,4-dione CAS Name: 1-methyl-3-[3-(3-thiophenyl)-1,2-benzothiazol-5-yl]-6-(trifluoromethyl)pyrimidine-2,4-dione IUPAC Name: 1-methyl-3-(3-thiophen-3-yl-1,2-benzothiazol-5-yl)-6-(trifluoromethyl)pyrimidine-2,4-dione Traditional Name: 1-methyl-3-[3-(3-thienyl)-1,2-benzothiazol-5-yl]-6-(trifluoromethyl)pyrimidine-2,4-quinone Formula: C17H10F3N3O2S2 MolecularWeight: 409.40541

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=O)N(C1=O)C2=CC3=C(C=C2)SN=C3C4=CSC=C4)C(F)(F)F

Isomeric SMILES

CN1C(=CC(=O)N(C1=O)C2=CC3=C(C=C2)SN=C3C4=CSC=C4)C(F)(F)F

InChI

InChI=1S/C17H10F3N3O2S2/c1-22-13(17(18,19)20)7-14(24)23(16(22)25)10-2-3-12-11(6-10)15(21-27-12)9-4-5-26-8-9/h2-8H,1H3