7-(diethylamino)-6-nitro-4-(trifluoromethyl)-3H-1,3-benzothiazole-2-thione

Systemtic Name: 7-(diethylamino)-6-nitro-4-(trifluoromethyl)-3H-1,3-benzothiazole-2-thione Openeye Name: 7-(diethylamino)-6-nitro-4-(trifluoromethyl)-3H-1,3-benzothiazole-2-thione CAS Name: 7-(diethylamino)-6-nitro-4-(trifluoromethyl)-3H-1,3-benzothiazole-2-thione IUPAC Name: 7-(diethylamino)-6-nitro-4-(trifluoromethyl)-3H-1,3-benzothiazole-2-thione Traditional Name: 7-(diethylamino)-6-nitro-4-(trifluoromethyl)-3H-1,3-benzothiazole-2-thione Formula: C12H12F3N3O2S2 MolecularWeight: 351.36779

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=C(C2=C1SC(=S)N2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C1=C(C=C(C2=C1SC(=S)N2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C12H12F3N3O2S2/c1-3-17(4-2)9-7(18(19)20)5-6(12(13,14)15)8-10(9)22-11(21)16-8/h5H,3-4H2,1-2H3,(H,16,21)