2-[1-[2-(methylamino)-2-oxidanylidene-ethyl]imidazol-2-yl]sulfanylethanoic acid

Systemtic Name: 2-[1-[2-(methylamino)-2-oxidanylidene-ethyl]imidazol-2-yl]sulfanylethanoic acid Openeye Name: 2-[1-[2-(methylamino)-2-oxo-ethyl]imidazol-2-yl]sulfanylacetic acid CAS Name: 2-[[1-[2-(methylamino)-2-oxoethyl]-2-imidazolyl]thio]acetic acid IUPAC Name: 2-[1-[2-(methylamino)-2-oxoethyl]imidazol-2-yl]sulfanylacetic acid Traditional Name: 2-[[1-[2-keto-2-(methylamino)ethyl]imidazol-2-yl]thio]acetic acid Formula: C8H11N3O3S MolecularWeight: 229.25624

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CN1C=CN=C1SCC(=O)O

Isomeric SMILES

CNC(=O)CN1C=CN=C1SCC(=O)O

InChI

InChI=1S/C8H11N3O3S/c1-9-6(12)4-11-3-2-10-8(11)15-5-7(13)14/h2-3H,4-5H2,1H3,(H,9,12)(H,13,14)