O-(2,2-dimethylpropyl) [(3R,4R)-4-methyl-5-oxidanylidene-1-pentyl-pyrrolidin-3-yl]methylsulfanylmethanethioate

Systemtic Name: O-(2,2-dimethylpropyl) [(3R,4R)-4-methyl-5-oxidanylidene-1-pentyl-pyrrolidin-3-yl]methylsulfanylmethanethioate Openeye Name: O-(2,2-dimethylpropyl) [(3R,4R)-4-methyl-5-oxo-1-pentyl-pyrrolidin-3-yl]methylsulfanylmethanethioate CAS Name: [[(3R,4R)-4-methyl-5-oxo-1-pentyl-3-pyrrolidinyl]methylthio]methanethioic acid O-(2,2-dimethylpropyl) ester IUPAC Name: O-(2,2-dimethylpropyl) [(3R,4R)-4-methyl-5-oxo-1-pentylpyrrolidin-3-yl]methylsulfanylmethanethioate Traditional Name: [[(3R,4R)-1-amyl-5-keto-4-methyl-pyrrolidin-3-yl]methylthio]methanethioic acid O-neopentyl ester Formula: C17H31NO2S2 MolecularWeight: 345.56354

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1CC(C(C1=O)C)CSC(=S)OCC(C)(C)C

Isomeric SMILES

CCCCCN1C[C@@H]([C@H](C1=O)C)CSC(=S)OCC(C)(C)C

InChI

InChI=1S/C17H31NO2S2/c1-6-7-8-9-18-10-14(13(2)15(18)19)11-22-16(21)20-12-17(3,4)5/h13-14H,6-12H2,1-5H3/t13-,14-/m1/s1