(3aS,6S,7R,7aS)-7-Benzyloxy-3,6-dimethyl-5-(phenylsulfonyl)octahydro[1,3]thiazolo[4,5-c]pyridine

SpectraBase Compound ID	4FdX7sQzyWX
InChI	InChI=1S/C21H26N2O3S2/c1-16-20(26-14-17-9-5-3-6-10-17)21-19(22(2)15-27-21)13-23(16)28(24,25)18-11-7-4-8-12-18/h3-12,16,19-21H,13-15H2,1-2H3/t16-,19-,20+,21-/m0/s1
InChIKey	OWIGSMYQXRMISI-DVWBAYGPSA-N Google Search
Mol Weight	418.57 g/mol
Molecular Formula	C21H26N2O3S2
Exact Mass	418.138485 g/mol

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SpectraBase Spectrum ID	K6R8LFgShi3
Name	(3aS,6S,7R,7aS)-7-Benzyloxy-3,6-dimethyl-5-(phenylsulfonyl)octahydro[1,3]thiazolo[4,5-c]pyridine
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C21H26N2O3S2
InChI	InChI=1S/C21H26N2O3S2/c1-16-20(26-14-17-9-5-3-6-10-17)21-19(22(2)15-27-21)13-23(16)28(24,25)18-11-7-4-8-12-18/h3-12,16,19-21H,13-15H2,1-2H3/t16-,19-,20+,21-/m0/s1
InChIKey	OWIGSMYQXRMISI-DVWBAYGPSA-N
Molecular Weight	418.570 g/mol
SMILES	C1[C@]2([C@@]([C@@]([C@@](N1S(=O)(=O)c1ccccc1)(C)[H])(OCc1ccccc1)[H])(SCN2C)[H])[H]
SPLASH	splash10-016r-4653900000-632b00e71bdbdc626953
Source of Spectrum	J-67-3192-24
Synonyms	(3aS,6S,7R,7aS)-3,6-dimethyl-5-(phenylsulfonyl)octahydro[1,3]thiazolo[4,5-c]pyridin-7-yl benzyl ether (3aS,6S,7R,7aS)-5-(benzenesulfonyl)-3,6-dimethyl-7-phenylmethoxy-2,3a,4,6,7,7a-hexahydrothiazolo[4,5-c]pyridine (3aS,6S,7R,7aS)-5-(benzenesulfonyl)-3,6-dimethyl-7-phenylmethoxy-2,3a,4,6,7,7a-hexahydro-[1,3]thiazolo[4,5-c]pyridine (3aS,6S,7R,7aS)-5-(benzenesulfonyl)-7-benzyloxy-3,6-dimethyl-2,3a,4,6,7,7a-hexahydrothiazolo[4,5-c]pyridine (3aS,6S,7R,7aS)-3,6-dimethyl-7-phenylmethoxy-5-(phenylsulfonyl)-2,3a,4,6,7,7a-hexahydro-[1,3]thiazolo[4,5-c]pyridine
Wiley ID	1569744