Vitas-M small molecule compound

methyl 4-[({[(1R)-octahydro-2H-quinolizin-1-ylmethoxy]carbonyl}sulfamoyl)oxy]benzoate

Catalog ID
STK683921
SMILES COC(=O)c1ccc(cc1)OS(=O)(=O)NC(=O)OC[C@@H]1CCCN2C1CCCC2

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C19H26N2O7S MW 426.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H26N2O7S/c1-26-18(22)14-7-9-16(10-8-14)28-29(24,25)20-19(23)27-13-15-5-4-12-21-11-3-2-6-17(15)21/h7-10,15,17H,2-6,11-13H2,1H3,(H,20,23)/t15-,17?/m0/s1
InChIKey
KDFAYNUSUDUCCW-MYJWUSKBSA-N
Synonyms
COC(=O)C1=CC=C(C=C1)OS(=O)(=O)NC(=O)OCC2CCCN3C2CCCC3
COC(=O)c1ccc(cc1)OS(=O)(=O)NC(=O)OC(C@@H)1CCCN2C1CCCC2
methyl4(((((1R)octahydro2Hquinolizin1ylmethoxy)carbonyl)sulfamoyl)oxy)benzoate
methyl4(((1R)23467899aoctahydro1Hquinolizin1yl)methoxycarbonylsulfamoyloxy)benzoate
Registry IDs
MFCD18246916
ZINC000012417839
ZINC000015319812

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.