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

Systemtic Name: 2-[2,6-dinitro-4-(trifluoromethyl)phenyl]sulfanyl-5-methyl-1,3,4-thiadiazole Openeye Name: 2-[2,6-dinitro-4-(trifluoromethyl)phenyl]sulfanyl-5-methyl-1,3,4-thiadiazole CAS Name: 2-[[2,6-dinitro-4-(trifluoromethyl)phenyl]thio]-5-methyl-1,3,4-thiadiazole IUPAC Name: 2-[2,6-dinitro-4-(trifluoromethyl)phenyl]sulfanyl-5-methyl-1,3,4-thiadiazole Traditional Name: 2-[[2,6-dinitro-4-(trifluoromethyl)phenyl]thio]-5-methyl-1,3,4-thiadiazole Formula: C10H5F3N4O4S2 MolecularWeight: 366.29631

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)SC2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=NN=C(S1)SC2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C10H5F3N4O4S2/c1-4-14-15-9(22-4)23-8-6(16(18)19)2-5(10(11,12)13)3-7(8)17(20)21/h2-3H,1H3