[2-[(4-bromanyl-1H-imidazol-5-yl)methylsulfanyl]ethylamino]-methylimino-methanesulfonic acid

Systemtic Name: [2-[(4-bromanyl-1H-imidazol-5-yl)methylsulfanyl]ethylamino]-methylimino-methanesulfonic acid Openeye Name: [2-[(4-bromo-1H-imidazol-5-yl)methylsulfanyl]ethylamino]-methylimino-methanesulfonic acid CAS Name: [2-[(4-bromo-1H-imidazol-5-yl)methylthio]ethylamino]-methyliminomethanesulfonic acid IUPAC Name: [2-[(4-bromo-1H-imidazol-5-yl)methylsulfanyl]ethylamino]-methyliminomethanesulfonic acid Traditional Name: [2-[(4-bromo-1H-imidazol-5-yl)methylthio]ethylamino]-methylimino-methanesulfonic acid Formula: C8H13BrN4O3S2 MolecularWeight: 357.24782

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Descriptors Computed from Structure

Canonical SMILES:

CN=C(NCCSCC1=C(N=CN1)Br)S(=O)(=O)O

Isomeric SMILES

CN=C(NCCSCC1=C(N=CN1)Br)S(=O)(=O)O

InChI

InChI=1S/C8H13BrN4O3S2/c1-10-8(18(14,15)16)11-2-3-17-4-6-7(9)13-5-12-6/h5H,2-4H2,1H3,(H,10,11)(H,12,13)(H,14,15,16)