(2S,4S)-1-[(2S)-2-methyl-3-sulfanyl-propanoyl]-4-naphthalen-2-ylsulfanyl-pyrrolidine-2-carboxylic acid

Systemtic Name: (2S,4S)-1-[(2S)-2-methyl-3-sulfanyl-propanoyl]-4-naphthalen-2-ylsulfanyl-pyrrolidine-2-carboxylic acid Openeye Name: (2S,4S)-1-[(2S)-2-methyl-3-sulfanyl-propanoyl]-4-(2-naphthylsulfanyl)pyrrolidine-2-carboxylic acid CAS Name: (2S,4S)-1-[(2S)-3-mercapto-2-methyl-1-oxopropyl]-4-(2-naphthalenylthio)-2-pyrrolidinecarboxylic acid IUPAC Name: (2S,4S)-1-[(2S)-2-methyl-3-sulfanylpropanoyl]-4-naphthalen-2-ylsulfanylpyrrolidine-2-carboxylic acid Traditional Name: (2S,4S)-1-[(2S)-3-mercapto-2-methyl-propanoyl]-4-(2-naphthylthio)proline Formula: C19H21NO3S2 MolecularWeight: 375.50494

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H](CS)C(=O)N1C[C@H](C[C@H]1C(=O)O)SC2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C19H21NO3S2/c1-12(11-24)18(21)20-10-16(9-17(20)19(22)23)25-15-7-6-13-4-2-3-5-14(13)8-15/h2-8,12,16-17,24H,9-11H2,1H3,(H,22,23)/t12-,16+,17+/m1/s1