Vitas-M small molecule compound
2-(diethylamino)ethyl 2-methyl-5-nitrobenzenesulfonate
Catalog ID
STK177382
SMILES CCN(CCOS(=O)(=O)c1cc(ccc1C)[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 C13H20N2O5S MW 316.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H20N2O5S/c1-4-14(5-2)8-9-20-21(18,19)13-10-12(15(16)17)7-6-11(13)3/h6-7,10H,4-5,8-9H2,1-3H3InChIKey
APSSVKAWSGYEKQ-UHFFFAOYSA-NSynonyms
2(DIETHYLAMINO)ETHYL2METHYL5NITROBENZENESULFONATE
2DIETHYLAMINOETHYL2METHYL5NITROBENZENESULFONATE
CCN(CC)CCOS(=O)(=O)C1=C(C=CC(=C1)(N+)(=O)(O))C
CCN(CCOS(=O)(=O)c1cc(ccc1C)(N+)(=O)(O))CC
InChI=1SC13H20N2O5Sc1414(52)892021(1819)131012(15(16)17)7611(13)3h6710H4589H213H3
MFCD01218679
ZINC000002892024
ZINC2892024
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