[(2S,3R,6R)-4-tert-butyl-2,6-bis(tert-butylsulfanyl)-1-ethanoyl-3,6-dihydro-2H-pyridin-3-yl] ethanoate

Systemtic Name: [(2S,3R,6R)-4-tert-butyl-2,6-bis(tert-butylsulfanyl)-1-ethanoyl-3,6-dihydro-2H-pyridin-3-yl] ethanoate Openeye Name: [(2S,3R,6R)-1-acetyl-4-tert-butyl-2,6-bis(tert-butylsulfanyl)-3,6-dihydro-2H-pyridin-3-yl] acetate CAS Name: acetic acid [(2S,3R,6R)-1-acetyl-4-tert-butyl-2,6-bis(tert-butylthio)-3,6-dihydro-2H-pyridin-3-yl] ester IUPAC Name: [(2S,3R,6R)-1-acetyl-4-tert-butyl-2,6-bis(tert-butylsulfanyl)-3,6-dihydro-2H-pyridin-3-yl] acetate Traditional Name: acetic acid [(2S,3R,6R)-1-acetyl-4-tert-butyl-2,6-bis(tert-butylthio)-3,6-dihydro-2H-pyridin-3-yl] ester Formula: C21H37NO3S2 MolecularWeight: 415.65338

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(C=C(C(C1SC(C)(C)C)OC(=O)C)C(C)(C)C)SC(C)(C)C

Isomeric SMILES

CC(=O)N1[C@@H](C=C([C@H]([C@@H]1SC(C)(C)C)OC(=O)C)C(C)(C)C)SC(C)(C)C

InChI

InChI=1S/C21H37NO3S2/c1-13(23)22-16(26-20(6,7)8)12-15(19(3,4)5)17(25-14(2)24)18(22)27-21(9,10)11/h12,16-18H,1-11H3/t16-,17-,18+/m1/s1