Vitas-M small molecule compound

2-chloro-N'-(2-cyanoethyl)-N'-(1,1-dioxido-1,2-benzothiazol-3-yl)benzohydrazide

Catalog ID
STK135641
SMILES N#CCCN(C1=NS(=O)(=O)c2c1cccc2)NC(=O)c1ccccc1Cl

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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 C17H13ClN4O3S MW 388.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13ClN4O3S/c18-14-8-3-1-6-12(14)17(23)20-22(11-5-10-19)16-13-7-2-4-9-15(13)26(24,25)21-16/h1-4,6-9H,5,11H2,(H,20,23)
InChIKey
MSOFHNMHZLVAPY-UHFFFAOYSA-N
Synonyms

2CHLORON(2CYANOETHYL)N(11DIOXIDO12BENZOTHIAZOL3YL)BENZOHYDRAZIDE
2CHLORON(2CYANOETHYL)N(11DIOXO12BENZOTHIAZOL3YL)BENZOHYDRAZIDE
C1=CC=C2C(=C1)C(=NS2(=O)=O)N(CCC#N)NC(=O)C3=CC=CC=C3Cl
InChI=1SC17H13ClN4O3Sc1814831612(14)17(23)2022(1151019)1613724915(13)26(2425)2116h1469H511H2(H2023)
MFCD01579613
ZINC000004681129
ZINC04681129
ZINC4681129

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Available files

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