1-(2-nitro-4-oxidanyl-phenyl)-3-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]urea

Systemtic Name: 1-(2-nitro-4-oxidanyl-phenyl)-3-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]urea Openeye Name: 1-(4-hydroxy-2-nitro-phenyl)-3-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]urea CAS Name: 1-(4-hydroxy-2-nitrophenyl)-3-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]urea IUPAC Name: 1-(4-hydroxy-2-nitrophenyl)-3-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]urea Traditional Name: 1-(4-hydroxy-2-nitro-phenyl)-3-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]urea Formula: C10H6F3N5O4S MolecularWeight: 349.24595

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1O)[N+](=O)[O-])NC(=O)NC2=NN=C(S2)C(F)(F)F

Isomeric SMILES

C1=CC(=C(C=C1O)[N+](=O)[O-])NC(=O)NC2=NN=C(S2)C(F)(F)F

InChI

InChI=1S/C10H6F3N5O4S/c11-10(12,13)7-16-17-9(23-7)15-8(20)14-5-2-1-4(19)3-6(5)18(21)22/h1-3,19H,(H2,14,15,17,20)