tert-butyl (5R)-2-oxidanylidene-5-[(phenylmethylsulfanyl)methyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (5R)-2-oxidanylidene-5-[(phenylmethylsulfanyl)methyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2R)-2-(benzylsulfanylmethyl)-5-oxo-pyrrolidine-1-carboxylate CAS Name: (5R)-2-oxo-5-[(phenylmethylthio)methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R)-2-(benzylsulfanylmethyl)-5-oxopyrrolidine-1-carboxylate Traditional Name: (2R)-2-[(benzylthio)methyl]-5-keto-pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C17H23NO3S MolecularWeight: 321.43442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(CCC1=O)CSCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N1[C@H](CCC1=O)CSCC2=CC=CC=C2

InChI

InChI=1S/C17H23NO3S/c1-17(2,3)21-16(20)18-14(9-10-15(18)19)12-22-11-13-7-5-4-6-8-13/h4-8,14H,9-12H2,1-3H3/t14-/m1/s1