Vitas-M small molecule compound
(5aS,9aR)-2-phenyl-1,2,3,4,5a,6,7,8,9,9a-decahydropyridazino[4,5-b]quinoxaline 5,10-dioxide
Catalog ID
STK551263
SMILES [O-][N+]1=C2CN(NCC2=[N+]([C@@H]2[C@H]1CCCC2)[O-])c1ccccc1
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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 C16H20N4O2 MW 300.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N4O2/c21-19-13-8-4-5-9-14(13)20(22)16-11-18(17-10-15(16)19)12-6-2-1-3-7-12/h1-3,6-7,13-14,17H,4-5,8-11H2/t13-,14+/m0/s1InChIKey
KGNZFYBUJSEABH-UONOGXRCSA-NSynonyms
1214630-58-6(5aS9aR)10oxido2phenyl345a67899aoctahydro1Hpyridazino(45b)quinoxalin5ium5oxide
(5aS9aR)2phenyl12345a67899adecahydropyridazino(45b)quinoxaline510dioxide
(O)(N+)1=C2CN(NCC2=(N+)((C@@H)2(C@H)1CCCC2)(O))c1ccccc1
1214630586
C1CCC2C(C1)N(C3=C((N+)2=O)CNN(C3)C4=CC=CC=C4)(O)
InChI=1SC16H20N4O2c211913845914(13)20(22)161118(171015(16)19)126213712h1367131417H45811H2t1314+m0s1
MFCD18242577
ZINC000334157025
ZINC05031265
ZINC5031265
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