2-[(2-methyl-3-sulfanyl-propanoyl)-(1-thiophen-2-ylethyl)amino]ethanoic acid

Systemtic Name: 2-[(2-methyl-3-sulfanyl-propanoyl)-(1-thiophen-2-ylethyl)amino]ethanoic acid Openeye Name: 2-[(2-methyl-3-sulfanyl-propanoyl)-[1-(2-thienyl)ethyl]amino]acetic acid CAS Name: 2-[(3-mercapto-2-methyl-1-oxopropyl)-(1-thiophen-2-ylethyl)amino]acetic acid IUPAC Name: 2-[(2-methyl-3-sulfanylpropanoyl)-(1-thiophen-2-ylethyl)amino]acetic acid Traditional Name: 2-[(3-mercapto-2-methyl-propanoyl)-[1-(2-thienyl)ethyl]amino]acetic acid Formula: C12H17NO3S2 MolecularWeight: 287.39828

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS)C(=O)N(CC(=O)O)C(C)C1=CC=CS1

Isomeric SMILES

CC(CS)C(=O)N(CC(=O)O)C(C)C1=CC=CS1

InChI

InChI=1S/C12H17NO3S2/c1-8(7-17)12(16)13(6-11(14)15)9(2)10-4-3-5-18-10/h3-5,8-9,17H,6-7H2,1-2H3,(H,14,15)