3-[2-(2-sulfanylidene-1,3-dihydroimidazol-4-yl)ethylamino]propanoic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC(=S)N1)CCNCCC(=O)O

Isomeric SMILES

C1=C(NC(=S)N1)CCNCCC(=O)O

InChI

InChI=1S/C8H13N3O2S/c12-7(13)2-4-9-3-1-6-5-10-8(14)11-6/h5,9H,1-4H2,(H,12,13)(H2,10,11,14)