Vitas-M small molecule compound

2-chloro-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-nitrobenzamide

Catalog ID
STK444881
SMILES CCc1nnc(s1)NC(=O)c1cc(ccc1Cl)[N+](=O)[O-]

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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 C11H9ClN4O3S MW 312.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H9ClN4O3S/c1-2-9-14-15-11(20-9)13-10(17)7-5-6(16(18)19)3-4-8(7)12/h3-5H,2H2,1H3,(H,13,15,17)
InChIKey
DUENIGWFWIKFOX-UHFFFAOYSA-N
Synonyms

(2CHLORO5NITROPHENYL)N(5ETHYL(134THIADIAZOL2YL))CARBOXAMIDE
2chloroN(5ethyl134thiadiazol2yl)5nitrobenzamide
CCC1=NN=C(S1)NC(=O)C2=C(C=CC(=C2)(N+)(=O)(O))Cl
CCc1nnc(s1)NC(=O)c1cc(ccc1Cl)(N+)(=O)(O)
InChI=1SC11H9ClN4O3Sc129141511(209)1310(17)756(16(18)19)348(7)12h35H2H21H3(H131517)
MFCD01328151
ZINC000000097626
ZINC00097626
ZINC97626

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Available files

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