Vitas-M small molecule compound
2-ethoxy-4-(morpholin-4-ylcarbonothioyl)phenyl 2-nitrobenzenesulfonate
Catalog ID
STL383039
SMILES CCOc1cc(ccc1OS(=O)(=O)c1ccccc1[N+](=O)[O-])C(=S)N1CCOCC1
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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 C19H20N2O7S2 MW 452.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N2O7S2/c1-2-27-17-13-14(19(29)20-9-11-26-12-10-20)7-8-16(17)28-30(24,25)18-6-4-3-5-15(18)21(22)23/h3-8,13H,2,9-12H2,1H3InChIKey
QWMNPRKZFUPCSL-UHFFFAOYSA-NSynonyms
(2ETHOXY4(MORPHOLINE4CARBOTHIOYL)PHENYL)2NITROBENZENESULFONATE
2ETHOXY4(4MORPHOLINYLCARBONOTHIOYL)PHENYL2NITROBENZENESULFONATE
2ethoxy4(morpholin4ylcarbonothioyl)phenyl2nitrobenzenesulfonate
CCOC1=C(C=CC(=C1)C(=S)N2CCOCC2)OS(=O)(=O)C3=CC=CC=C3(N+)(=O)(O)
CCOc1cc(ccc1OS(=O)(=O)c1ccccc1(N+)(=O)(O))C(=S)N1CCOCC1
InChI=1SC19H20N2O7S2c1227171314(19(29)2091126121020)7816(17)2830(2425)18643515(18)21(22)23h3813H2912H21H3
MFCD02581020
ZINC000002987623
ZINC02987623
ZINC2987623
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