2-azanyl-3-[(2-ethyl-1,3-thiazol-4-yl)methylsulfanyl]propanoic acid

Systemtic Name: 2-azanyl-3-[(2-ethyl-1,3-thiazol-4-yl)methylsulfanyl]propanoic acid Openeye Name: 2-amino-3-[(2-ethylthiazol-4-yl)methylsulfanyl]propanoic acid CAS Name: 2-amino-3-[(2-ethyl-4-thiazolyl)methylthio]propanoic acid IUPAC Name: 2-amino-3-[(2-ethyl-1,3-thiazol-4-yl)methylsulfanyl]propanoic acid Traditional Name: 2-amino-3-[(2-ethylthiazol-4-yl)methylthio]propionic acid Formula: C9H14N2O2S2 MolecularWeight: 246.34966

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=CS1)CSCC(C(=O)O)N

Isomeric SMILES

CCC1=NC(=CS1)CSCC(C(=O)O)N

InChI

InChI=1S/C9H14N2O2S2/c1-2-8-11-6(4-15-8)3-14-5-7(10)9(12)13/h4,7H,2-3,5,10H2,1H3,(H,12,13)