Vitas-M small molecule compound

2-(methylsulfonyl)-6-nitro-1,3-benzothiazole

Catalog ID
STK541963
SMILES [O-][N+](=O)c1ccc2c(c1)sc(n2)S(=O)(=O)C

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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 C8H6N2O4S2 MW 258.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H6N2O4S2/c1-16(13,14)8-9-6-3-2-5(10(11)12)4-7(6)15-8/h2-4H,1H3
InChIKey
XZXMLEUCJADXIG-UHFFFAOYSA-N
Synonyms
21554-41-6
(O)(N+)(=O)c1ccc2c(c1)sc(n2)S(=O)(=O)C
2(methylsulfonyl)6nitro13benzothiazole
2(METHYLSULFONYL)6NITROBENZO(D)THIAZOLE
21554416
2METHYLSULFONYL6NITRO13BENZOTHIAZOLE
2METHYLSULFONYL6NITROBENZOTHIAZOLE
BENZOTHIAZOLE2(METHYLSULFONYL)6NITRO
CS(=O)(=O)C1=NC2=C(S1)C=C(C=C2)(N+)(=O)(O)
InChI=1SC8H6N2O4S2c116(1314)896325(10(11)12)47(6)158h24H1H3
METHYL6NITROBENZOTHIAZOLYL2SULFONE
MFCD00799566
ZINC000001857478
ZINC01857478
ZINC1857478

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Available files

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