5-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-N-ethyl-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-N-ethyl-1,3,4-thiadiazol-2-amine Openeye Name: 5-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-N-ethyl-1,3,4-thiadiazol-2-amine CAS Name: 5-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-N-ethyl-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-N-ethyl-1,3,4-thiadiazol-2-amine Traditional Name: [5-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-1,3,4-thiadiazol-2-yl]-ethyl-amine Formula: C13H14BrN3O2S2 MolecularWeight: 388.30316

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NN=C(S1)SCC2=CC3=C(C=C2Br)OCCO3

Isomeric SMILES

CCNC1=NN=C(S1)SCC2=CC3=C(C=C2Br)OCCO3

InChI

InChI=1S/C13H14BrN3O2S2/c1-2-15-12-16-17-13(21-12)20-7-8-5-10-11(6-9(8)14)19-4-3-18-10/h5-6H,2-4,7H2,1H3,(H,15,16)