3,4-dimethyl-1-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]pyrrole-2,5-dione

Systemtic Name: 3,4-dimethyl-1-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]pyrrole-2,5-dione Openeye Name: 3,4-dimethyl-1-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]pyrrole-2,5-dione CAS Name: 3,4-dimethyl-1-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]pyrrole-2,5-dione IUPAC Name: 3,4-dimethyl-1-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]pyrrole-2,5-dione Traditional Name: 3,4-dimethyl-1-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]-3-pyrroline-2,5-quinone Formula: C14H9F3N2O2S MolecularWeight: 326.29367

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C1=O)C2=NC3=C(S2)C=CC(=C3)C(F)(F)F)C

Isomeric SMILES

CC1=C(C(=O)N(C1=O)C2=NC3=C(S2)C=CC(=C3)C(F)(F)F)C

InChI

InChI=1S/C14H9F3N2O2S/c1-6-7(2)12(21)19(11(6)20)13-18-9-5-8(14(15,16)17)3-4-10(9)22-13/h3-5H,1-2H3