Vitas-M small molecule compound

2-[(2E)-2-(1,3-benzodioxol-5-ylmethylidene)-1-(1,1-dioxido-1,2-benzothiazol-3-yl)hydrazinyl]ethanol

Catalog ID
STK133511
SMILES OCCN(C1=NS(=O)(=O)c2c1cccc2)/N=C/c1ccc2c(c1)OCO2

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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 C17H15N3O5S MW 373.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15N3O5S/c21-8-7-20(17-13-3-1-2-4-16(13)26(22,23)19-17)18-10-12-5-6-14-15(9-12)25-11-24-14/h1-6,9-10,21H,7-8,11H2/b18-10+
InChIKey
CFCMMSJJUPEXDU-VCHYOVAHSA-N
Synonyms

2(((E)13benzodioxol5ylmethylideneamino)(11dioxo12benzothiazol3yl)amino)ethanol
2((2E)2(13BENZODIOXOL5YLMETHYLIDENE)1(11DIOXIDO12BENZOTHIAZOL3YL)HYDRAZINYL)ETHANOL
C1OC2=C(O1)C=C(C=C2)C=NN(CCO)C3=NS(=O)(=O)C4=CC=CC=C43
InChI=1SC17H15N3O5Sc218720(1713312416(13)26(2223)1917)181012561415(912)25112414h1691021H7811H2b1810+
MFCD03214983
OCCN(C1=NS(=O)(=O)c2c1cccc2)N=Cc1ccc2c(c1)OCO2
ZINC000001461799
ZINC33340185

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Available files

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