3-(1-methyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-yl)propanoic acid

Systemtic Name: 3-(1-methyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-yl)propanoic acid Openeye Name: 3-(1-methyl-5-oxo-2-thioxo-imidazolidin-4-yl)propanoic acid CAS Name: 3-(1-methyl-5-oxo-2-sulfanylidene-4-imidazolidinyl)propanoic acid IUPAC Name: 3-(1-methyl-5-oxo-2-sulfanylideneimidazolidin-4-yl)propanoic acid Traditional Name: 3-(5-keto-1-methyl-2-thioxo-imidazolidin-4-yl)propionic acid Formula: C7H10N2O3S MolecularWeight: 202.2309

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(NC1=S)CCC(=O)O

Isomeric SMILES

CN1C(=O)C(NC1=S)CCC(=O)O

InChI

InChI=1S/C7H10N2O3S/c1-9-6(12)4(8-7(9)13)2-3-5(10)11/h4H,2-3H2,1H3,(H,8,13)(H,10,11)