2-cyclopentylsulfanyl-5-[2,6-dinitro-4-(trifluoromethyl)phenyl]sulfanyl-1,3,4-thiadiazole

Systemtic Name: 2-cyclopentylsulfanyl-5-[2,6-dinitro-4-(trifluoromethyl)phenyl]sulfanyl-1,3,4-thiadiazole Openeye Name: 2-cyclopentylsulfanyl-5-[2,6-dinitro-4-(trifluoromethyl)phenyl]sulfanyl-1,3,4-thiadiazole CAS Name: 2-(cyclopentylthio)-5-[[2,6-dinitro-4-(trifluoromethyl)phenyl]thio]-1,3,4-thiadiazole IUPAC Name: 2-cyclopentylsulfanyl-5-[2,6-dinitro-4-(trifluoromethyl)phenyl]sulfanyl-1,3,4-thiadiazole Traditional Name: 2-(cyclopentylthio)-5-[[2,6-dinitro-4-(trifluoromethyl)phenyl]thio]-1,3,4-thiadiazole Formula: C14H11F3N4O4S3 MolecularWeight: 452.45175

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)SC2=NN=C(S2)SC3=C(C=C(C=C3[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1CCC(C1)SC2=NN=C(S2)SC3=C(C=C(C=C3[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C14H11F3N4O4S3/c15-14(16,17)7-5-9(20(22)23)11(10(6-7)21(24)25)27-13-19-18-12(28-13)26-8-3-1-2-4-8/h5-6,8H,1-4H2