1-(3-ethanoylsulfanyl-2-methyl-propanoyl)-4-naphthalen-2-ylsulfanyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-(3-ethanoylsulfanyl-2-methyl-propanoyl)-4-naphthalen-2-ylsulfanyl-pyrrolidine-2-carboxylic acid Openeye Name: 1-(3-acetylsulfanyl-2-methyl-propanoyl)-4-(2-naphthylsulfanyl)pyrrolidine-2-carboxylic acid CAS Name: 1-[3-(acetylthio)-2-methyl-1-oxopropyl]-4-(2-naphthalenylthio)-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(3-acetylsulfanyl-2-methylpropanoyl)-4-naphthalen-2-ylsulfanylpyrrolidine-2-carboxylic acid Traditional Name: 1-[3-(acetylthio)-2-methyl-propanoyl]-4-(2-naphthylthio)proline Formula: C21H23NO4S2 MolecularWeight: 417.54162

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC(=O)C)C(=O)N1CC(CC1C(=O)O)SC2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CC(CSC(=O)C)C(=O)N1CC(CC1C(=O)O)SC2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C21H23NO4S2/c1-13(12-27-14(2)23)20(24)22-11-18(10-19(22)21(25)26)28-17-8-7-15-5-3-4-6-16(15)9-17/h3-9,13,18-19H,10-12H2,1-2H3,(H,25,26)