Vitas-M small molecule compound

S-{2-[(5-nitro-1,3-thiazol-2-yl)amino]-2-oxoethyl} sulfurothioate

Catalog ID
STK870249
SMILES O=C(Nc1ncc(s1)[N+](=O)[O-])CSS(=O)(=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 C5H4N3O6S3 MW 298.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C5H5N3O6S3/c9-3(2-15-17(12,13)14)7-5-6-1-4(16-5)8(10)11/h1H,2H2,(H,6,7,9)(H,12,13,14)/p-1
InChIKey
IPNBMURKMKFCKQ-UHFFFAOYSA-M
Synonyms

((N(5NITRO(13THIAZOL2YL))CARBAMOYL)METHYL)THIOSULFONICACID
5NITRO2((2SULFONATOSULFANYLACETYL)AMINO)13THIAZOLE
C1=C(SC(=N1)NC(=O)CSS(=O)(=O)(O))(N+)(=O)(O)
InChI=1SC5H5N3O6S3c93(21517(1213)14)75614(165)8(10)11h1H2H2(H679)(H121314)p1
O=C(Nc1ncc(s1)(N+)(=O)(O))CSS(=O)(=O)(O)
S(2((5nitro13thiazol2yl)amino)2oxoethyl)sulfurothioate
ZINC000008856383
ZINC08856383

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Available files

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