3-[2-(2,3-dihydro-1H-inden-2-yl)ethanoyl]-4-sulfanylidene-pyrrolidine-2-carboxylic acid

Systemtic Name: 3-[2-(2,3-dihydro-1H-inden-2-yl)ethanoyl]-4-sulfanylidene-pyrrolidine-2-carboxylic acid Openeye Name: 3-(2-indan-2-ylacetyl)-4-thioxo-pyrrolidine-2-carboxylic acid CAS Name: 3-[2-(2,3-dihydro-1H-inden-2-yl)-1-oxoethyl]-4-sulfanylidene-2-pyrrolidinecarboxylic acid IUPAC Name: 3-[2-(2,3-dihydro-1H-inden-2-yl)acetyl]-4-sulfanylidenepyrrolidine-2-carboxylic acid Traditional Name: 3-(2-indan-2-ylacetyl)-4-thioxo-proline Formula: C16H17NO3S MolecularWeight: 303.37608

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC2=CC=CC=C21)CC(=O)C3C(NCC3=S)C(=O)O

Isomeric SMILES

C1C(CC2=CC=CC=C21)CC(=O)C3C(NCC3=S)C(=O)O

InChI

InChI=1S/C16H17NO3S/c18-12(14-13(21)8-17-15(14)16(19)20)7-9-5-10-3-1-2-4-11(10)6-9/h1-4,9,14-15,17H,5-8H2,(H,19,20)