Vitas-M small molecule compound
[4-(benzylsulfanyl)-2,6-dinitrophenyl](morpholin-4-yl)methanone
Catalog ID
STK762778
SMILES [O-][N+](=O)c1cc(SCc2ccccc2)cc(c1C(=O)N1CCOCC1)[N+](=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 C18H17N3O6S MW 403.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N3O6S/c22-18(19-6-8-27-9-7-19)17-15(20(23)24)10-14(11-16(17)21(25)26)28-12-13-4-2-1-3-5-13/h1-5,10-11H,6-9,12H2InChIKey
KABUPJAPVANRRI-UHFFFAOYSA-NSynonyms
(26DINITRO4(BENZYLTHIO)PHENYL)(MORPHOLINO)KETONE
(4(benzylsulfanyl)26dinitrophenyl)(morpholin4yl)methanone
(4BENZYLSULFANYL26DINITROPHENYL)MORPHOLIN4YLMETHANONE
(O)(N+)(=O)c1cc(SCc2ccccc2)cc(c1C(=O)N1CCOCC1)(N+)(=O)(O)
C1COCCN1C(=O)C2=C(C=C(C=C2(N+)(=O)(O))SCC3=CC=CC=C3)(N+)(=O)(O)
InChI=1SC18H17N3O6Sc2218(1968279719)1715(20(23)24)1014(1116(17)21(25)26)2812134213513h151011H6912H2
MFCD02110522
ZINC000003671453
ZINC03671453
ZINC3671453
Check stock
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Check stock on Vitas-MAvailable files
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