2-[(2-methyl-2-sulfanyl-propanoyl)-(thian-4-yl)amino]ethanoic acid

Systemtic Name: 2-[(2-methyl-2-sulfanyl-propanoyl)-(thian-4-yl)amino]ethanoic acid Openeye Name: 2-[(2-methyl-2-sulfanyl-propanoyl)-tetrahydrothiopyran-4-yl-amino]acetic acid CAS Name: 2-[(2-mercapto-2-methyl-1-oxopropyl)-(4-thianyl)amino]acetic acid IUPAC Name: 2-[(2-methyl-2-sulfanylpropanoyl)-(thian-4-yl)amino]acetic acid Traditional Name: 2-[(2-mercapto-2-methyl-propanoyl)-tetrahydrothiopyran-4-yl-amino]acetic acid Formula: C11H19NO3S2 MolecularWeight: 277.40346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)N(CC(=O)O)C1CCSCC1)S

Isomeric SMILES

CC(C)(C(=O)N(CC(=O)O)C1CCSCC1)S

InChI

InChI=1S/C11H19NO3S2/c1-11(2,16)10(15)12(7-9(13)14)8-3-5-17-6-4-8/h8,16H,3-7H2,1-2H3,(H,13,14)