Vitas-M small molecule compound
3-(4-bromophenyl)-8,9-dimethoxy-5,5-dimethyl-5,6-dihydro[1,2,4]triazolo[3,4-a]isoquinoline
Catalog ID
STK839425
SMILES COc1cc2c(cc1OC)CC(n1c2nnc1c1ccc(cc1)Br)(C)C
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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 C20H20BrN3O2 MW 414.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20BrN3O2/c1-20(2)11-13-9-16(25-3)17(26-4)10-15(13)19-23-22-18(24(19)20)12-5-7-14(21)8-6-12/h5-10H,11H2,1-4H3InChIKey
SKADITUKTVFDHO-UHFFFAOYSA-NSynonyms
301352-52-33(4bromophenyl)89dimethoxy55dimethyl56dihydro(124)triazolo(34a)isoquinoline
3(4BROMOPHENYL)89DIMETHOXY55DIMETHYL6H(124)TRIAZOLO(34A)ISOQUINOLINE
301352523
CC1(CC2=CC(=C(C=C2C3=NN=C(N31)C4=CC=C(C=C4)Br)OC)OC)C
InChI=1SC20H20BrN3O2c120(2)1113916(253)17(264)1015(13)19232218(24(19)20)125714(21)8612h510H11H214H3
MFCD00608511
ZINC000000816637
ZINC00816637
ZINC816637
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