2-(4-methyl-3-nitro-phenyl)sulfonyl-5-(trifluoromethyl)-1,3,4-thiadiazole

Systemtic Name: 2-(4-methyl-3-nitro-phenyl)sulfonyl-5-(trifluoromethyl)-1,3,4-thiadiazole Openeye Name: 2-(4-methyl-3-nitro-phenyl)sulfonyl-5-(trifluoromethyl)-1,3,4-thiadiazole CAS Name: 2-(4-methyl-3-nitrophenyl)sulfonyl-5-(trifluoromethyl)-1,3,4-thiadiazole IUPAC Name: 2-(4-methyl-3-nitrophenyl)sulfonyl-5-(trifluoromethyl)-1,3,4-thiadiazole Traditional Name: 2-(4-methyl-3-nitro-phenyl)sulfonyl-5-(trifluoromethyl)-1,3,4-thiadiazole Formula: C10H6F3N3O4S2 MolecularWeight: 353.29755

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C2=NN=C(S2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C2=NN=C(S2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C10H6F3N3O4S2/c1-5-2-3-6(4-7(5)16(17)18)22(19,20)9-15-14-8(21-9)10(11,12)13/h2-4H,1H3