Vitas-M small molecule compound
6-[3-(3,4-dihydroisoquinolin-2(1H)-ylsulfonyl)-4,5-dimethylphenyl]pyridazin-3(2H)-one
Catalog ID
STL571844
SMILES Cc1cc(cc(c1C)S(=O)(=O)N1CCc2c(C1)cccc2)c1ccc(=O)[nH]n1
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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 C21H21N3O3S MW 395.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O3S/c1-14-11-18(19-7-8-21(25)23-22-19)12-20(15(14)2)28(26,27)24-10-9-16-5-3-4-6-17(16)13-24/h3-8,11-12H,9-10,13H2,1-2H3,(H,23,25)InChIKey
VBCBTLRTMQZCSD-UHFFFAOYSA-NSynonyms
22586604
3(3(34dihydro1Hisoquinolin2ylsulfonyl)45dimethylphenyl)1Hpyridazin6one
6(3(34dihydroisoquinolin2(1H)ylsulfonyl)45dimethylphenyl)pyridazin3(2H)one
InChI=1SC21H21N3O3Sc1141118(197821(25)232219)1220(15(14)2)28(2627)2410916534617(16)1324h381112H91013H212H3(H2325)
MFCD15077572
ZINC000015866633
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