1-(5-phenylpentanoyl)-3-sulfanylidene-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-(5-phenylpentanoyl)-3-sulfanylidene-pyrrolidine-2-carboxylic acid Openeye Name: 1-(5-phenylpentanoyl)-3-thioxo-pyrrolidine-2-carboxylic acid CAS Name: 1-(1-oxo-5-phenylpentyl)-3-sulfanylidene-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(5-phenylpentanoyl)-3-sulfanylidenepyrrolidine-2-carboxylic acid Traditional Name: 1-(5-phenylpentanoyl)-3-thioxo-proline Formula: C16H19NO3S MolecularWeight: 305.39196

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C1=S)C(=O)O)C(=O)CCCCC2=CC=CC=C2

Isomeric SMILES

C1CN(C(C1=S)C(=O)O)C(=O)CCCCC2=CC=CC=C2

InChI

InChI=1S/C16H19NO3S/c18-14(17-11-10-13(21)15(17)16(19)20)9-5-4-8-12-6-2-1-3-7-12/h1-3,6-7,15H,4-5,8-11H2,(H,19,20)