2-[[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]sulfanylamino]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]sulfanylamino]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]sulfanylamino]-2-oxo-acetic acid CAS Name: 2-[[[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethylamino]thio]amino]-2-oxoacetic acid IUPAC Name: 2-[[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]sulfanylamino]-2-oxoacetic acid Traditional Name: 2-keto-2-[[[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethylamino]thio]amino]acetic acid Formula: C9H14N4O3S2 MolecularWeight: 290.36246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1)CSCCNSNC(=O)C(=O)O

Isomeric SMILES

CC1=C(N=CN1)CSCCNSNC(=O)C(=O)O

InChI

InChI=1S/C9H14N4O3S2/c1-6-7(11-5-10-6)4-17-3-2-12-18-13-8(14)9(15)16/h5,12H,2-4H2,1H3,(H,10,11)(H,13,14)(H,15,16)