2-[methyl-[3-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]propanoyl]amino]ethanoic acid

Systemtic Name: 2-[methyl-[3-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]propanoyl]amino]ethanoic acid Openeye Name: 2-[methyl-[3-[(2-methylthiazol-4-yl)methylsulfanyl]propanoyl]amino]acetic acid CAS Name: 2-[methyl-[3-[(2-methyl-4-thiazolyl)methylthio]-1-oxopropyl]amino]acetic acid IUPAC Name: 2-[methyl-[3-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]propanoyl]amino]acetic acid Traditional Name: 2-[methyl-[3-[(2-methylthiazol-4-yl)methylthio]propanoyl]amino]acetic acid Formula: C11H16N2O3S2 MolecularWeight: 288.38634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CSCCC(=O)N(C)CC(=O)O

Isomeric SMILES

CC1=NC(=CS1)CSCCC(=O)N(C)CC(=O)O

InChI

InChI=1S/C11H16N2O3S2/c1-8-12-9(7-18-8)6-17-4-3-10(14)13(2)5-11(15)16/h7H,3-6H2,1-2H3,(H,15,16)