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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=NN=C(S1)SCC2=CC3=C(C=C2Br)OCCO3

Isomeric SMILES

CC(C)CNC1=NN=C(S1)SCC2=CC3=C(C=C2Br)OCCO3

InChI

InChI=1S/C15H18BrN3O2S2/c1-9(2)7-17-14-18-19-15(23-14)22-8-10-5-12-13(6-11(10)16)21-4-3-20-12/h5-6,9H,3-4,7-8H2,1-2H3,(H,17,18)