N-ethyl-5-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1,3,4-thiadiazol-2-amine

Systemtic Name: N-ethyl-5-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1,3,4-thiadiazol-2-amine Openeye Name: N-ethyl-5-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1,3,4-thiadiazol-2-amine CAS Name: N-ethyl-5-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylthio]-1,3,4-thiadiazol-2-amine IUPAC Name: N-ethyl-5-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1,3,4-thiadiazol-2-amine Traditional Name: ethyl-[5-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylthio]-1,3,4-thiadiazol-2-yl]amine Formula: C13H14FN3O2S2 MolecularWeight: 327.397563

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NN=C(S1)SCC2=C3C(=CC(=C2)F)COCO3

Isomeric SMILES

CCNC1=NN=C(S1)SCC2=C3C(=CC(=C2)F)COCO3

InChI

InChI=1S/C13H14FN3O2S2/c1-2-15-12-16-17-13(21-12)20-6-9-4-10(14)3-8-5-18-7-19-11(8)9/h3-4H,2,5-7H2,1H3,(H,15,16)