2-[(2-acetamido-1,3-thiazol-4-yl)methylsulfanyl]ethanoic acid

Systemtic Name: 2-[(2-acetamido-1,3-thiazol-4-yl)methylsulfanyl]ethanoic acid Openeye Name: 2-[(2-acetamidothiazol-4-yl)methylsulfanyl]acetic acid CAS Name: 2-[(2-acetamido-4-thiazolyl)methylthio]acetic acid IUPAC Name: 2-[(2-acetamido-1,3-thiazol-4-yl)methylsulfanyl]acetic acid Traditional Name: 2-[(2-acetamidothiazol-4-yl)methylthio]acetic acid Formula: C8H10N2O3S2 MolecularWeight: 246.3066

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=CS1)CSCC(=O)O

Isomeric SMILES

CC(=O)NC1=NC(=CS1)CSCC(=O)O

InChI

InChI=1S/C8H10N2O3S2/c1-5(11)9-8-10-6(3-15-8)2-14-4-7(12)13/h3H,2,4H2,1H3,(H,12,13)(H,9,10,11)