4-(phenylmethylsulfanyl)-1-(3-sulfanylpentanoyl)pyrrolidine-2-carboxylic acid

Systemtic Name: 4-(phenylmethylsulfanyl)-1-(3-sulfanylpentanoyl)pyrrolidine-2-carboxylic acid Openeye Name: 4-benzylsulfanyl-1-(3-sulfanylpentanoyl)pyrrolidine-2-carboxylic acid CAS Name: 1-(3-mercapto-1-oxopentyl)-4-(phenylmethylthio)-2-pyrrolidinecarboxylic acid IUPAC Name: 4-benzylsulfanyl-1-(3-sulfanylpentanoyl)pyrrolidine-2-carboxylic acid Traditional Name: 4-(benzylthio)-1-(3-mercaptopentanoyl)proline Formula: C17H23NO3S2 MolecularWeight: 353.49942

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(=O)N1CC(CC1C(=O)O)SCC2=CC=CC=C2)S

Isomeric SMILES

CCC(CC(=O)N1CC(CC1C(=O)O)SCC2=CC=CC=C2)S

InChI

InChI=1S/C17H23NO3S2/c1-2-13(22)8-16(19)18-10-14(9-15(18)17(20)21)23-11-12-6-4-3-5-7-12/h3-7,13-15,22H,2,8-11H2,1H3,(H,20,21)