2-[(3-ethanoylsulfanyl-2-methyl-propanoyl)-(thiophen-2-ylmethyl)amino]ethanoic acid

Systemtic Name: 2-[(3-ethanoylsulfanyl-2-methyl-propanoyl)-(thiophen-2-ylmethyl)amino]ethanoic acid Openeye Name: 2-[(3-acetylsulfanyl-2-methyl-propanoyl)-(2-thienylmethyl)amino]acetic acid CAS Name: 2-[[3-(acetylthio)-2-methyl-1-oxopropyl]-(thiophen-2-ylmethyl)amino]acetic acid IUPAC Name: 2-[(3-acetylsulfanyl-2-methylpropanoyl)-(thiophen-2-ylmethyl)amino]acetic acid Traditional Name: 2-[[3-(acetylthio)-2-methyl-propanoyl]-(2-thenyl)amino]acetic acid Formula: C13H17NO4S2 MolecularWeight: 315.40838

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC(=O)C)C(=O)N(CC1=CC=CS1)CC(=O)O

Isomeric SMILES

CC(CSC(=O)C)C(=O)N(CC1=CC=CS1)CC(=O)O

InChI

InChI=1S/C13H17NO4S2/c1-9(8-20-10(2)15)13(18)14(7-12(16)17)6-11-4-3-5-19-11/h3-5,9H,6-8H2,1-2H3,(H,16,17)