2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-5-(5-nitrofuran-2-yl)-1,3,4-thiadiazole

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-5-(5-nitrofuran-2-yl)-1,3,4-thiadiazole Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-5-(5-nitro-2-furyl)-1,3,4-thiadiazole CAS Name: 2-[(2-chloro-6-fluorophenyl)methylthio]-5-(5-nitro-2-furanyl)-1,3,4-thiadiazole IUPAC Name: 2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-5-(5-nitrofuran-2-yl)-1,3,4-thiadiazole Traditional Name: 2-[(2-chloro-6-fluoro-benzyl)thio]-5-(5-nitro-2-furyl)-1,3,4-thiadiazole Formula: C13H7ClFN3O3S2 MolecularWeight: 371.794383

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)CSC2=NN=C(S2)C3=CC=C(O3)[N+](=O)[O-])F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CSC2=NN=C(S2)C3=CC=C(O3)[N+](=O)[O-])F

InChI

InChI=1S/C13H7ClFN3O3S2/c14-8-2-1-3-9(15)7(8)6-22-13-17-16-12(23-13)10-4-5-11(21-10)18(19)20/h1-5H,6H2