1-(6-fluoranyl-1,3-benzothiazol-2-yl)-3,4-dimethyl-pyrrole-2,5-dione

Systemtic Name: 1-(6-fluoranyl-1,3-benzothiazol-2-yl)-3,4-dimethyl-pyrrole-2,5-dione Openeye Name: 1-(6-fluoro-1,3-benzothiazol-2-yl)-3,4-dimethyl-pyrrole-2,5-dione CAS Name: 1-(6-fluoro-1,3-benzothiazol-2-yl)-3,4-dimethylpyrrole-2,5-dione IUPAC Name: 1-(6-fluoro-1,3-benzothiazol-2-yl)-3,4-dimethylpyrrole-2,5-dione Traditional Name: 1-(6-fluoro-1,3-benzothiazol-2-yl)-3,4-dimethyl-3-pyrroline-2,5-quinone Formula: C13H9FN2O2S MolecularWeight: 276.286163

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H9FN2O2S/c1-6-7(2)12(18)16(11(6)17)13-15-9-4-3-8(14)5-10(9)19-13/h3-5H,1-2H3