tert-butyl (3R)-3-oxidanyl-3-(pyridin-4-ylsulfanylmethyl)pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (3R)-3-oxidanyl-3-(pyridin-4-ylsulfanylmethyl)pyrrolidine-1-carboxylate Openeye Name: tert-butyl (3R)-3-hydroxy-3-(4-pyridylsulfanylmethyl)pyrrolidine-1-carboxylate CAS Name: (3R)-3-hydroxy-3-[(pyridin-4-ylthio)methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3R)-3-hydroxy-3-(pyridin-4-ylsulfanylmethyl)pyrrolidine-1-carboxylate Traditional Name: (3R)-3-hydroxy-3-[(4-pyridylthio)methyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C15H22N2O3S MolecularWeight: 310.41178

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(C1)(CSC2=CC=NC=C2)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CC[C@@](C1)(CSC2=CC=NC=C2)O

InChI

InChI=1S/C15H22N2O3S/c1-14(2,3)20-13(18)17-9-6-15(19,10-17)11-21-12-4-7-16-8-5-12/h4-5,7-8,19H,6,9-11H2,1-3H3/t15-/m1/s1