Vitas-M small molecule compound
1-[2-nitro-5-({2-[(4-phenyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}sulfanyl)phenyl]piperidine
Catalog ID
STK017141
SMILES [O-][N+](=O)c1ccc(cc1N1CCCCC1)SCCOc1nonc1c1ccccc1
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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 C21H22N4O4S MW 426.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O4S/c26-25(27)18-10-9-17(15-19(18)24-11-5-2-6-12-24)30-14-13-28-21-20(22-29-23-21)16-7-3-1-4-8-16/h1,3-4,7-10,15H,2,5-6,11-14H2InChIKey
ACFSNTGFRBWARG-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1ccc(cc1N1CCCCC1)SCCOc1nonc1c1ccccc1
1(2NITRO5((2((4PHENYL125OXADIAZOL3YL)OXY)ETHYL)SULFANYL)PHENYL)PIPERIDINE
3(2(4NITRO3PIPERIDIN1YLPHENYL)SULFANYLETHOXY)4PHENYL125OXADIAZOLE
C1CCN(CC1)C2=C(C=CC(=C2)SCCOC3=NON=C3C4=CC=CC=C4)(N+)(=O)(O)
InChI=1SC21H22N4O4Sc2625(27)1810917(1519(18)24115261224)301413282120(22292321)167314816h13471015H2561114H2
MFCD01203158
STK017141
ZINC000008984791
ZINC08984791
ZINC8984791
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