Vitas-M small molecule compound
4-(6-chloro[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)butan-1-one
Catalog ID
STL408843
SMILES COc1cc2CN(CCc2cc1OC)C(=O)CCCc1nnc2n1nc(Cl)cc2
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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 C20H22ClN5O3 MW 415.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22ClN5O3/c1-28-15-10-13-8-9-25(12-14(13)11-16(15)29-2)20(27)5-3-4-18-22-23-19-7-6-17(21)24-26(18)19/h6-7,10-11H,3-5,8-9,12H2,1-2H3InChIKey
ABRAAUAYKXXXCZ-UHFFFAOYSA-NSynonyms
1574531-03-51574531035
4(6chloro(124)triazolo(43b)pyridazin3yl)1(67dimethoxy34dihydro1Hisoquinolin2yl)butan1one
4(6chloro(124)triazolo(43b)pyridazin3yl)1(67dimethoxy34dihydroisoquinolin2(1H)yl)butan1one
COC1=C(C=C2CN(CCC2=C1)C(=O)CCCC3=NN=C4N3N=C(C=C4)Cl)OC
InChI=1SC20H22ClN5O3c1281510138925(1214(13)1116(15)292)20(27)534182223197617(21)2426(18)19h671011H358912H212H3
MFCD28058808
ZINC000096231511
ZINC96231511
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