Vitas-M small molecule compound

2-(morpholin-4-ylcarbonothioyl)phenyl 2-nitrobenzenesulfonate

Catalog ID
STK382183
SMILES S=C(c1ccccc1OS(=O)(=O)c1ccccc1[N+](=O)[O-])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 C17H16N2O6S2 MW 408.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2O6S2/c20-19(21)14-6-2-4-8-16(14)27(22,23)25-15-7-3-1-5-13(15)17(26)18-9-11-24-12-10-18/h1-8H,9-12H2
InChIKey
HVKOWYYMIJKBRR-UHFFFAOYSA-N
Synonyms

(2(MORPHOLINE4CARBOTHIOYL)PHENYL)2NITROBENZENESULFONATE
2(morpholin4ylcarbonothioyl)phenyl2nitrobenzenesulfonate
2(MORPHOLIN4YLTHIOXOMETHYL)PHENYL2NITROBENZENESULFONATE
C1COCCN1C(=S)C2=CC=CC=C2OS(=O)(=O)C3=CC=CC=C3(N+)(=O)(O)
InChI=1SC17H16N2O6S2c2019(21)14624816(14)27(2223)2515731513(15)17(26)1891124121018h18H912H2
MFCD02581038
S=C(c1ccccc1OS(=O)(=O)c1ccccc1(N+)(=O)(O))N1CCOCC1
ZINC000004543444
ZINC04543444
ZINC4543444

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Available files

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