Vitas-M small molecule compound

dimethyl (3-methoxy-6-nitro-1,2-benzothiazol-4-yl)phosphoramidate

Catalog ID
STK675999
SMILES COc1nsc2c1c(cc(c2)[N+](=O)[O-])NP(=O)(OC)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 C10H12N3O6PS MW 333.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H12N3O6PS/c1-17-10-9-7(11-20(16,18-2)19-3)4-6(13(14)15)5-8(9)21-12-10/h4-5H,1-3H3,(H,11,16)
InChIKey
UJKHIFCGVAKIJI-UHFFFAOYSA-N
Synonyms

COC1=NSC2=C1C(=CC(=C2)(N+)(=O)(O))NP(=O)(OC)OC
COc1nsc2c1c(cc(c2)(N+)(=O)(O))NP(=O)(OC)OC
dimethyl(3methoxy6nitro12benzothiazol4yl)phosphoramidate
InChI=1SC10H12N3O6PSc1171097(1120(16182)193)46(13(14)15)58(9)211210h45H13H3(H1116)
MFCD02110240
NDIMETHOXYPHOSPHORYL3METHOXY6NITRO12BENZOTHIAZOL4AMINE
ZINC000004536373
ZINC04536373
ZINC4536373

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Available files

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