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

Systemtic Name: 3-(3-methyl-1,2-benzothiazol-5-yl)-1-prop-2-ynyl-6-(trifluoromethyl)pyrimidine-2,4-dione Openeye Name: 3-(3-methyl-1,2-benzothiazol-5-yl)-1-prop-2-ynyl-6-(trifluoromethyl)pyrimidine-2,4-dione CAS Name: 3-(3-methyl-1,2-benzothiazol-5-yl)-1-prop-2-ynyl-6-(trifluoromethyl)pyrimidine-2,4-dione IUPAC Name: 3-(3-methyl-1,2-benzothiazol-5-yl)-1-prop-2-ynyl-6-(trifluoromethyl)pyrimidine-2,4-dione Traditional Name: 3-(3-methyl-1,2-benzothiazol-5-yl)-1-propargyl-6-(trifluoromethyl)pyrimidine-2,4-quinone Formula: C16H10F3N3O2S MolecularWeight: 365.32971

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC2=C1C=C(C=C2)N3C(=O)C=C(N(C3=O)CC#C)C(F)(F)F

Isomeric SMILES

CC1=NSC2=C1C=C(C=C2)N3C(=O)C=C(N(C3=O)CC#C)C(F)(F)F

InChI

InChI=1S/C16H10F3N3O2S/c1-3-6-21-13(16(17,18)19)8-14(23)22(15(21)24)10-4-5-12-11(7-10)9(2)20-25-12/h1,4-5,7-8H,6H2,2H3