Vitas-M small molecule compound

N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-3,5-dinitrobenzamide

Catalog ID
STK125422
SMILES CCSc1nnc(s1)NC(=O)c1cc(cc(c1)[N+](=O)[O-])[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 C11H9N5O5S2 MW 355.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H9N5O5S2/c1-2-22-11-14-13-10(23-11)12-9(17)6-3-7(15(18)19)5-8(4-6)16(20)21/h3-5H,2H2,1H3,(H,12,13,17)
InChIKey
CAAOMJNRPWTFSC-UHFFFAOYSA-N
Synonyms

CCSC1=NN=C(S1)NC(=O)C2=CC(=CC(=C2)(N+)(=O)(O))(N+)(=O)(O)
CCSc1nnc(s1)NC(=O)c1cc(cc(c1)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC11H9N5O5S2c122211141310(2311)129(17)637(15(18)19)58(46)16(20)21h35H2H21H3(H121317)
MFCD00824255
N(5(ETHYLSULFANYL)134THIADIAZOL2YL)35BISNITROBENZAMIDE
N(5(ETHYLSULFANYL)134THIADIAZOL2YL)35DINITROBENZAMIDE
N(5ETHYLSULFANYL134THIADIAZOL2YL)35DINITROBENZAMIDE
ZINC000002187081
ZINC02187081
ZINC2187081

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Available files

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