(2S,5S)-1-[(2S)-2-methyl-3-sulfanyl-propanoyl]-5-(naphthalen-2-ylmethylsulfanyl)pyrrolidine-2-carboxylic acid

Systemtic Name: (2S,5S)-1-[(2S)-2-methyl-3-sulfanyl-propanoyl]-5-(naphthalen-2-ylmethylsulfanyl)pyrrolidine-2-carboxylic acid Openeye Name: (2S,5S)-1-[(2S)-2-methyl-3-sulfanyl-propanoyl]-5-(2-naphthylmethylsulfanyl)pyrrolidine-2-carboxylic acid CAS Name: (2S,5S)-1-[(2S)-3-mercapto-2-methyl-1-oxopropyl]-5-(2-naphthalenylmethylthio)-2-pyrrolidinecarboxylic acid IUPAC Name: (2S,5S)-1-[(2S)-2-methyl-3-sulfanylpropanoyl]-5-(naphthalen-2-ylmethylsulfanyl)pyrrolidine-2-carboxylic acid Traditional Name: (2S,5S)-1-[(2S)-3-mercapto-2-methyl-propanoyl]-5-(2-naphthylmethylthio)proline Formula: C20H23NO3S2 MolecularWeight: 389.53152

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS)C(=O)N1C(CCC1SCC2=CC3=CC=CC=C3C=C2)C(=O)O

Isomeric SMILES

C[C@H](CS)C(=O)N1[C@@H](CC[C@@H]1SCC2=CC3=CC=CC=C3C=C2)C(=O)O

InChI

InChI=1S/C20H23NO3S2/c1-13(11-25)19(22)21-17(20(23)24)8-9-18(21)26-12-14-6-7-15-4-2-3-5-16(15)10-14/h2-7,10,13,17-18,25H,8-9,11-12H2,1H3,(H,23,24)/t13-,17+,18+/m1/s1