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

Systemtic Name: 3-(3-methyl-1,2-benzothiazol-5-yl)-1-(phenylmethyl)-6-(trifluoromethyl)pyrimidine-2,4-dione Openeye Name: 1-benzyl-3-(3-methyl-1,2-benzothiazol-5-yl)-6-(trifluoromethyl)pyrimidine-2,4-dione CAS Name: 3-(3-methyl-1,2-benzothiazol-5-yl)-1-(phenylmethyl)-6-(trifluoromethyl)pyrimidine-2,4-dione IUPAC Name: 1-benzyl-3-(3-methyl-1,2-benzothiazol-5-yl)-6-(trifluoromethyl)pyrimidine-2,4-dione Traditional Name: 1-benzyl-3-(3-methyl-1,2-benzothiazol-5-yl)-6-(trifluoromethyl)pyrimidine-2,4-quinone Formula: C20H14F3N3O2S MolecularWeight: 417.40427

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC2=C1C=C(C=C2)N3C(=O)C=C(N(C3=O)CC4=CC=CC=C4)C(F)(F)F

Isomeric SMILES

CC1=NSC2=C1C=C(C=C2)N3C(=O)C=C(N(C3=O)CC4=CC=CC=C4)C(F)(F)F

InChI

InChI=1S/C20H14F3N3O2S/c1-12-15-9-14(7-8-16(15)29-24-12)26-18(27)10-17(20(21,22)23)25(19(26)28)11-13-5-3-2-4-6-13/h2-10H,11H2,1H3