2-methyl-3-(2-sulfanylidene-1,3-dihydroimidazol-4-yl)propanoic acid

Systemtic Name: 2-methyl-3-(2-sulfanylidene-1,3-dihydroimidazol-4-yl)propanoic acid Openeye Name: 2-methyl-3-(2-thioxo-1,3-dihydroimidazol-4-yl)propanoic acid CAS Name: 2-methyl-3-(2-sulfanylidene-1,3-dihydroimidazol-4-yl)propanoic acid IUPAC Name: 2-methyl-3-(2-sulfanylidene-1,3-dihydroimidazol-4-yl)propanoic acid Traditional Name: 2-methyl-3-(2-thioxo-4-imidazolin-4-yl)propionic acid Formula: C7H10N2O2S MolecularWeight: 186.2315

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CNC(=S)N1)C(=O)O

Isomeric SMILES

CC(CC1=CNC(=S)N1)C(=O)O

InChI

InChI=1S/C7H10N2O2S/c1-4(6(10)11)2-5-3-8-7(12)9-5/h3-4H,2H2,1H3,(H,10,11)(H2,8,9,12)