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

Systemtic Name: 2-(dimethylamino)-3-(2-sulfanylidene-1,3-dihydroimidazol-4-yl)propanoic acid Openeye Name: 2-(dimethylamino)-3-(2-thioxo-1,3-dihydroimidazol-4-yl)propanoic acid CAS Name: 2-(dimethylamino)-3-(2-sulfanylidene-1,3-dihydroimidazol-4-yl)propanoic acid IUPAC Name: 2-(dimethylamino)-3-(2-sulfanylidene-1,3-dihydroimidazol-4-yl)propanoic acid Traditional Name: 2-(dimethylamino)-3-(2-thioxo-4-imidazolin-4-yl)propionic acid Formula: C8H13N3O2S MolecularWeight: 215.27272

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H13N3O2S/c1-11(2)6(7(12)13)3-5-4-9-8(14)10-5/h4,6H,3H2,1-2H3,(H,12,13)(H2,9,10,14)