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

Systemtic Name: 1-methyl-3-(3-prop-2-ynoxy-1,2-benzothiazol-5-yl)-6-(trifluoromethyl)pyrimidine-2,4-dione Openeye Name: 1-methyl-3-(3-prop-2-ynoxy-1,2-benzothiazol-5-yl)-6-(trifluoromethyl)pyrimidine-2,4-dione CAS Name: 1-methyl-3-(3-prop-2-ynoxy-1,2-benzothiazol-5-yl)-6-(trifluoromethyl)pyrimidine-2,4-dione IUPAC Name: 1-methyl-3-(3-prop-2-ynoxy-1,2-benzothiazol-5-yl)-6-(trifluoromethyl)pyrimidine-2,4-dione Traditional Name: 1-methyl-3-(3-propargyloxy-1,2-benzothiazol-5-yl)-6-(trifluoromethyl)pyrimidine-2,4-quinone Formula: C16H10F3N3O3S MolecularWeight: 381.32911

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=O)N(C1=O)C2=CC3=C(C=C2)SN=C3OCC#C)C(F)(F)F

Isomeric SMILES

CN1C(=CC(=O)N(C1=O)C2=CC3=C(C=C2)SN=C3OCC#C)C(F)(F)F

InChI

InChI=1S/C16H10F3N3O3S/c1-3-6-25-14-10-7-9(4-5-11(10)26-20-14)22-13(23)8-12(16(17,18)19)21(2)15(22)24/h1,4-5,7-8H,6H2,2H3