1-(4-phenylbutanoyl)-4-sulfanylidene-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-(4-phenylbutanoyl)-4-sulfanylidene-pyrrolidine-2-carboxylic acid Openeye Name: 1-(4-phenylbutanoyl)-4-thioxo-pyrrolidine-2-carboxylic acid CAS Name: 1-(1-oxo-4-phenylbutyl)-4-sulfanylidene-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(4-phenylbutanoyl)-4-sulfanylidenepyrrolidine-2-carboxylic acid Traditional Name: 1-(4-phenylbutanoyl)-4-thioxo-proline Formula: C15H17NO3S MolecularWeight: 291.36538

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC1=S)C(=O)CCCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

C1C(N(CC1=S)C(=O)CCCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C15H17NO3S/c17-14(8-4-7-11-5-2-1-3-6-11)16-10-12(20)9-13(16)15(18)19/h1-3,5-6,13H,4,7-10H2,(H,18,19)