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

Systemtic Name: N-(furan-2-ylmethyl)-5-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-1,3,4-thiadiazol-2-amine Openeye Name: N-(2-furylmethyl)-5-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-1,3,4-thiadiazol-2-amine CAS Name: N-(2-furanylmethyl)-5-[[2-nitro-4-(trifluoromethyl)phenyl]thio]-1,3,4-thiadiazol-2-amine IUPAC Name: N-(furan-2-ylmethyl)-5-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-1,3,4-thiadiazol-2-amine Traditional Name: 2-furfuryl-[5-[[2-nitro-4-(trifluoromethyl)phenyl]thio]-1,3,4-thiadiazol-2-yl]amine Formula: C14H9F3N4O3S2 MolecularWeight: 402.37147

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CNC2=NN=C(S2)SC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1=COC(=C1)CNC2=NN=C(S2)SC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C14H9F3N4O3S2/c15-14(16,17)8-3-4-11(10(6-8)21(22)23)25-13-20-19-12(26-13)18-7-9-2-1-5-24-9/h1-6H,7H2,(H,18,19)