Vitas-M small molecule compound

N,N-diethyl-1-({2-[(2E)-2-(4-methoxybenzylidene)hydrazinyl]-5-nitrophenyl}sulfonyl)piperidine-3-carboxamide

Catalog ID
STK758726
SMILES CCN(C(=O)C1CCCN(C1)S(=O)(=O)c1cc(ccc1N/N=C/c1ccc(cc1)OC)[N+](=O)[O-])CC

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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 C24H31N5O6S MW 517.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H31N5O6S/c1-4-27(5-2)24(30)19-7-6-14-28(17-19)36(33,34)23-15-20(29(31)32)10-13-22(23)26-25-16-18-8-11-21(35-3)12-9-18/h8-13,15-16,19,26H,4-7,14,17H2,1-3H3/b25-16+
InChIKey
DFERTZLBFWSHOV-PCLIKHOPSA-N
Synonyms

CCN(C(=O)C1CCCN(C1)S(=O)(=O)c1cc(ccc1NN=Cc1ccc(cc1)OC)(N+)(=O)(O))CC
CCN(CC)C(=O)C1CCCN(C1)S(=O)(=O)C2=C(C=CC(=C2)(N+)(=O)(O))NN=CC3=CC=C(C=C3)OC
InChI=1SC24H31N5O6Sc1427(52)24(30)19761428(1719)36(3334)231520(29(31)32)101322(23)2625161881121(353)12918h81315161926H471417H213H3b2516+
MFCD01420230
NNdiethyl1((2((2E)2(4methoxybenzylidene)hydrazinyl)5nitrophenyl)sulfonyl)piperidine3carboxamide
NNdiethyl1(2((2E)2((4methoxyphenyl)methylidene)hydrazinyl)5nitrophenyl)sulfonylpiperidine3carboxamide
ZINC000008853739
ZINC000008853741

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Available files

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