Vitas-M small molecule compound

2-[(2E)-2-(3-chlorobenzylidene)-1-(1,1-dioxido-1,2-benzothiazol-3-yl)hydrazinyl]ethanol

Catalog ID
STL286972
SMILES OCCN(C1=NS(=O)(=O)c2c1cccc2)/N=C/c1cccc(c1)Cl

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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 C16H14ClN3O3S MW 363.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14ClN3O3S/c17-13-5-3-4-12(10-13)11-18-20(8-9-21)16-14-6-1-2-7-15(14)24(22,23)19-16/h1-7,10-11,21H,8-9H2/b18-11+
InChIKey
GFKPQAKSJSSKLT-WOJGMQOQSA-N
Synonyms
591242-46-5
2(((E)(3chlorophenyl)methylideneamino)(11dioxo12benzothiazol3yl)amino)ethanol
2((2E)2(3chlorobenzylidene)1(11dioxido12benzothiazol3yl)hydrazinyl)ethanol
591242465
C1=CC=C2C(=C1)C(=NS2(=O)=O)N(CCO)N=CC3=CC(=CC=C3)Cl
InChI=1SC16H14ClN3O3Sc171353412(1013)111820(8921)1614612715(14)24(2223)1916h17101121H89H2b1811+
MFCD04084634
OCCN(C1=NS(=O)(=O)c2c1cccc2)N=Cc1cccc(c1)Cl
ZINC000004320612
ZINC103719176

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Available files

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