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

Systemtic Name: 5-[2,6-dinitro-4-(trifluoromethyl)phenyl]sulfanyl-3H-1,3,4-thiadiazole-2-thione Openeye Name: 5-[2,6-dinitro-4-(trifluoromethyl)phenyl]sulfanyl-3H-1,3,4-thiadiazole-2-thione CAS Name: 5-[[2,6-dinitro-4-(trifluoromethyl)phenyl]thio]-3H-1,3,4-thiadiazole-2-thione IUPAC Name: 5-[2,6-dinitro-4-(trifluoromethyl)phenyl]sulfanyl-3H-1,3,4-thiadiazole-2-thione Traditional Name: 5-[[2,6-dinitro-4-(trifluoromethyl)phenyl]thio]-3H-1,3,4-thiadiazole-2-thione Formula: C9H3F3N4O4S3 MolecularWeight: 384.33473

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1[N+](=O)[O-])SC2=NNC(=S)S2)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1=C(C=C(C(=C1[N+](=O)[O-])SC2=NNC(=S)S2)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C9H3F3N4O4S3/c10-9(11,12)3-1-4(15(17)18)6(5(2-3)16(19)20)22-8-14-13-7(21)23-8/h1-2H,(H,13,21)