5-[5-chloranyl-2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-N-methyl-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[5-chloranyl-2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-N-methyl-1,3,4-thiadiazol-2-amine Openeye Name: 5-[5-chloro-2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-N-methyl-1,3,4-thiadiazol-2-amine CAS Name: 5-[[5-chloro-2-nitro-4-(trifluoromethyl)phenyl]thio]-N-methyl-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[5-chloro-2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-N-methyl-1,3,4-thiadiazol-2-amine Traditional Name: [5-[[5-chloro-2-nitro-4-(trifluoromethyl)phenyl]thio]-1,3,4-thiadiazol-2-yl]-methyl-amine Formula: C10H6ClF3N4O2S2 MolecularWeight: 370.75845

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NN=C(S1)SC2=C(C=C(C(=C2)Cl)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CNC1=NN=C(S1)SC2=C(C=C(C(=C2)Cl)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C10H6ClF3N4O2S2/c1-15-8-16-17-9(22-8)21-7-3-5(11)4(10(12,13)14)2-6(7)18(19)20/h2-3H,1H3,(H,15,16)