S-(tert-Butoxycarbonyloxy)methyl-Salubrinal Hydrochloride
Product Code
TRC-B692355-5MG
Product Format
Neat
Molecular Formula
C27 H27 Cl3 N4 O4 S . H Cl
Molecular Weight
646.413
Product Categories
Price and availability
Product Information
Product Data
Analyte Name
S-(tert-Butoxycarbonyloxy)methyl-Salubrinal Hydrochloride
Molecular Formula
C27 H27 Cl3 N4 O4 S . H Cl
Molecular Weight
646.413
Accurate Mass
644.059
SMILES
Cl.CC(C)(C)OC(=O)OCS\C(=N\c1cccc2cccnc12)\NC(NC(=O)\C=C\c3ccccc3)C(Cl)(Cl)Cl
InChI
InChI=1S/C27H27Cl3N4O4S.ClH/c1-26(2,3)38-25(36)37-17-39-24(32-20-13-7-11-19-12-8-16-31-22(19)20)34-23(27(28,29)30)33-21(35)15-14-18-9-5-4-6-10-18;/h4-16,23H,17H2,1-3H3,(H,32,34)(H,33,35);1H/b15-14+;
IUPAC
tert-butyl [(E)-N'-quinolin-8-yl-N-[2,2,2-trichloro-1-[[(E)-3-phenylprop-2-enoyl]amino]ethyl]carbamimidoyl]sulfanylmethyl carbonate;hydrochloride
Storage & Transport Information
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Attributes
Product Format
Neat
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