Vitas-M small molecule compound

3,5,5-trimethyl-4-[(Z)-(4-nitrobenzylidene)(oxido)-lambda~5~-azanyl]-1,3-thiazolidine-2-thione

Catalog ID
STK700329
SMILES [O-]/[N+](=C\c1ccc(cc1)[N+](=O)[O-])/C1N(C)C(=S)SC1(C)C

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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 C13H15N3O3S2 MW 325.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15N3O3S2/c1-13(2)11(14(3)12(20)21-13)15(17)8-9-4-6-10(7-5-9)16(18)19/h4-8,11H,1-3H3/b15-8-
InChIKey
CJDCUEUQJDOLDW-NVNXTCNLSA-N
Synonyms

(O)(N+)(=Cc1ccc(cc1)(N+)(=O)(O))C1N(C)C(=S)SC1(C)C
(Z)355trimethylN(4nitrobenzylidene)2thioxothiazolidin4amineoxide
1(4NITROPHENYL)N(355TRIMETHYL2SULFANYLIDENE13THIAZOLIDIN4YL)METHANIMINEOXIDE
355trimethyl4((Z)(4nitrobenzylidene)(oxido)lambda~5~azanyl)13thiazolidine2thione
355TRIMETHYL4((Z)(4NITROBENZYLIDENE)(OXIDO)LAMBDA5AZANYL)13THIAZOLIDINE2THIONE
AMINO((4NITROPHENYL)METHYLENE)(355TRIMETHYL2THIOXO(13THIAZOLIDIN4YL))1OL
CC1(C(N(C(=S)S1)C)(N+)(=CC2=CC=C(C=C2)(N+)(=O)(O))(O))C
InChI=1SC13H15N3O3S2c113(2)11(14(3)12(20)2113)15(17)894610(759)16(18)19h4811H13H3b158
ZINC000001309761
ZINC000001309763

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Available files

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