Vitas-M small molecule compound

(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)acetonitrile

Catalog ID
STK788557
SMILES N#CCN1C(=O)c2c(S1(=O)=O)cccc2

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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 C9H6N2O3S MW 222.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H6N2O3S/c10-5-6-11-9(12)7-3-1-2-4-8(7)15(11,13)14/h1-4H,6H2
InChIKey
XOOUGZKBOROESV-UHFFFAOYSA-N
Synonyms
52188-12-2
(113TRIOXO13DIHYDRO1LAMBDA6BENZO(D)ISOTHIAZOL2YL)ACETONITRILE
(11DIOXIDO3OXO12BENZISOTHIAZOL2(3H)YL)ACETONITRILE
(11dioxido3oxo12benzothiazol2(3H)yl)acetonitrile
2(113TRIOXO12BENZOTHIAZOL2YL)ACETONITRILE
2(113TRIOXO1E62BENZOTHIAZOL2YL)ACETONITRILE
2(113TRIOXO23DIHYDRO12BENZOTHIAZOL2YL)ACETONITRILE
2(113TRIOXO23DIHYDRO1E2BENZOTHIAZOL2YL)ACETONITRILE
2(113TRIOXO23DIHYDRO1H1LAMBDA6BENZO(D)ISOTHIAZOL2YL)ACETONITRILE
2(113TRIOXO2HYDROBENZO(D)ISOTHIAZOL2YL)ETHANENITRILE
2CYANOMETHYL12BENZISOTHIAZOL3(2H)ONE11DIOXIDE
2CYANOMETHYLBENZISOTHIAZOLINONE11DIOXIDE
52188122
C1=CC=C2C(=C1)C(=O)N(S2(=O)=O)CC#N
InChI=1SC9H6N2O3Sc1056119(12)731248(7)15(1113)14h14H6H2
MFCD00117404
NCYANOMETHYLSACCHARIN
ZINC000000050251
ZINC00050251
ZINC50251

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Available files

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