4-methylsulfanyl-2-[2-(2-methyl-1,3-thiazol-4-yl)ethanoylamino]butanoic acid

Systemtic Name: 4-methylsulfanyl-2-[2-(2-methyl-1,3-thiazol-4-yl)ethanoylamino]butanoic acid Openeye Name: 4-methylsulfanyl-2-[[2-(2-methylthiazol-4-yl)acetyl]amino]butanoic acid CAS Name: 2-[[2-(2-methyl-4-thiazolyl)-1-oxoethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 4-methylsulfanyl-2-[[2-(2-methyl-1,3-thiazol-4-yl)acetyl]amino]butanoic acid Traditional Name: 2-[[2-(2-methylthiazol-4-yl)acetyl]amino]-4-(methylthio)butyric acid Formula: C11H16N2O3S2 MolecularWeight: 288.38634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CC(=O)NC(CCSC)C(=O)O

Isomeric SMILES

CC1=NC(=CS1)CC(=O)NC(CCSC)C(=O)O

InChI

InChI=1S/C11H16N2O3S2/c1-7-12-8(6-18-7)5-10(14)13-9(11(15)16)3-4-17-2/h6,9H,3-5H2,1-2H3,(H,13,14)(H,15,16)