tert-butyl (2S,4R)-2-(methylsulfonyloxymethyl)-4-(triphenylmethyl)sulfanyl-pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2S,4R)-2-(methylsulfonyloxymethyl)-4-(triphenylmethyl)sulfanyl-pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2S,4R)-2-(methylsulfonyloxymethyl)-4-tritylsulfanyl-pyrrolidine-1-carboxylate CAS Name: (2S,4R)-2-(methylsulfonyloxymethyl)-4-[(triphenylmethyl)thio]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,4R)-2-(methylsulfonyloxymethyl)-4-tritylsulfanylpyrrolidine-1-carboxylate Traditional Name: (2S,4R)-2-(methylsulfonyloxymethyl)-4-(tritylthio)pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C30H35NO5S2 MolecularWeight: 553.7326

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC1COS(=O)(=O)C)SC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1C[C@@H](C[C@H]1COS(=O)(=O)C)SC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C30H35NO5S2/c1-29(2,3)36-28(32)31-21-27(20-26(31)22-35-38(4,33)34)37-30(23-14-8-5-9-15-23,24-16-10-6-11-17-24)25-18-12-7-13-19-25/h5-19,26-27H,20-22H2,1-4H3/t26-,27+/m0/s1