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

Systemtic Name: 5-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-N-butyl-1,3,4-thiadiazol-2-amine Openeye Name: 5-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-N-butyl-1,3,4-thiadiazol-2-amine CAS Name: 5-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-N-butyl-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-N-butyl-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]-butyl-amine Formula: C15H18BrN3O2S2 MolecularWeight: 416.35632

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NN=C(S1)SCC2=CC3=C(C=C2Br)OCCO3

Isomeric SMILES

CCCCNC1=NN=C(S1)SCC2=CC3=C(C=C2Br)OCCO3

InChI

InChI=1S/C15H18BrN3O2S2/c1-2-3-4-17-14-18-19-15(23-14)22-9-10-7-12-13(8-11(10)16)21-6-5-20-12/h7-8H,2-6,9H2,1H3,(H,17,18)