(2S,4R)-N-methyl-N-(4-methyl-2-oxidanylidene-pentyl)-1-naphthalen-2-ylsulfonyl-4-sulfanyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S,4R)-N-methyl-N-(4-methyl-2-oxidanylidene-pentyl)-1-naphthalen-2-ylsulfonyl-4-sulfanyl-pyrrolidine-2-carboxamide Openeye Name: (2S,4R)-N-methyl-N-(4-methyl-2-oxo-pentyl)-1-(2-naphthylsulfonyl)-4-sulfanyl-pyrrolidine-2-carboxamide CAS Name: (2S,4R)-4-mercapto-N-methyl-N-(4-methyl-2-oxopentyl)-1-(2-naphthalenylsulfonyl)-2-pyrrolidinecarboxamide IUPAC Name: (2S,4R)-N-methyl-N-(4-methyl-2-oxopentyl)-1-naphthalen-2-ylsulfonyl-4-sulfanylpyrrolidine-2-carboxamide Traditional Name: (2S,4R)-N-(2-keto-4-methyl-pentyl)-4-mercapto-N-methyl-1-(2-naphthylsulfonyl)pyrrolidine-2-carboxamide Formula: C22H28N2O4S2 MolecularWeight: 448.59872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)CN(C)C(=O)C1CC(CN1S(=O)(=O)C2=CC3=CC=CC=C3C=C2)S

Isomeric SMILES

CC(C)CC(=O)CN(C)C(=O)[C@@H]1C[C@H](CN1S(=O)(=O)C2=CC3=CC=CC=C3C=C2)S

InChI

InChI=1S/C22H28N2O4S2/c1-15(2)10-18(25)13-23(3)22(26)21-12-19(29)14-24(21)30(27,28)20-9-8-16-6-4-5-7-17(16)11-20/h4-9,11,15,19,21,29H,10,12-14H2,1-3H3/t19-,21+/m1/s1