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

Systemtic Name: 5-[5-chloranyl-2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-N-ethyl-1,3,4-thiadiazol-2-amine Openeye Name: 5-[5-chloro-2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-N-ethyl-1,3,4-thiadiazol-2-amine CAS Name: 5-[[5-chloro-2-nitro-4-(trifluoromethyl)phenyl]thio]-N-ethyl-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[5-chloro-2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-N-ethyl-1,3,4-thiadiazol-2-amine Traditional Name: [5-[[5-chloro-2-nitro-4-(trifluoromethyl)phenyl]thio]-1,3,4-thiadiazol-2-yl]-ethyl-amine Formula: C11H8ClF3N4O2S2 MolecularWeight: 384.78503

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NN=C(S1)SC2=C(C=C(C(=C2)Cl)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCNC1=NN=C(S1)SC2=C(C=C(C(=C2)Cl)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C11H8ClF3N4O2S2/c1-2-16-9-17-18-10(23-9)22-8-4-6(12)5(11(13,14)15)3-7(8)19(20)21/h3-4H,2H2,1H3,(H,16,17)