3-(2-methyl-3-sulfanyl-propanoyl)-2-sulfanylidene-pyrrolidine-1-carboxylic acid

Systemtic Name: 3-(2-methyl-3-sulfanyl-propanoyl)-2-sulfanylidene-pyrrolidine-1-carboxylic acid Openeye Name: 3-(2-methyl-3-sulfanyl-propanoyl)-2-thioxo-pyrrolidine-1-carboxylic acid CAS Name: 3-(3-mercapto-2-methyl-1-oxopropyl)-2-sulfanylidene-1-pyrrolidinecarboxylic acid IUPAC Name: 3-(2-methyl-3-sulfanylpropanoyl)-2-sulfanylidenepyrrolidine-1-carboxylic acid Traditional Name: 3-(3-mercapto-2-methyl-propanoyl)-2-thioxo-pyrrolidine-1-carboxylic acid Formula: C9H13NO3S2 MolecularWeight: 247.33442

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS)C(=O)C1CCN(C1=S)C(=O)O

Isomeric SMILES

CC(CS)C(=O)C1CCN(C1=S)C(=O)O

InChI

InChI=1S/C9H13NO3S2/c1-5(4-14)7(11)6-2-3-10(8(6)15)9(12)13/h5-6,14H,2-4H2,1H3,(H,12,13)