Vitas-M small molecule compound

dimethyl {5-[(1,3-benzodioxol-5-ylmethyl)amino]-2-(thiophen-2-yl)-1,3-oxazol-4-yl}phosphonate

Catalog ID
STK908079
SMILES COP(=O)(c1nc(oc1NCc1ccc2c(c1)OCO2)c1cccs1)OC

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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 C17H17N2O6PS MW 408.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N2O6PS/c1-21-26(20,22-2)17-16(25-15(19-17)14-4-3-7-27-14)18-9-11-5-6-12-13(8-11)24-10-23-12/h3-8,18H,9-10H2,1-2H3
InChIKey
XSFFUKGKHUYWAW-UHFFFAOYSA-N
Synonyms

COP(=O)(C1=C(OC(=N1)C2=CC=CS2)NCC3=CC4=C(C=C3)OCO4)OC
dimethyl(5((13benzodioxol5ylmethyl)amino)2(thiophen2yl)13oxazol4yl)phosphonate
InChI=1SC17H17N2O6PSc12126(20222)1716(2515(1917)144372714)18911561213(811)24102312h3818H910H212H3
MFCD06647596
N(13benzodioxol5ylmethyl)4dimethoxyphosphoryl2thiophen2yl13oxazol5amine
ZINC000016752205
ZINC16752205

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Available files

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