Vitas-M small molecule compound
8,9-dimethoxy-5,5-dimethyl-3-(2-nitrophenyl)-5,6-dihydro[1,2,4]triazolo[3,4-a]isoquinoline
Catalog ID
STK721782
SMILES COc1cc2c(cc1OC)CC(n1c2nnc1c1ccccc1[N+](=O)[O-])(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 C20H20N4O4 MW 380.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O4/c1-20(2)11-12-9-16(27-3)17(28-4)10-14(12)19-22-21-18(23(19)20)13-7-5-6-8-15(13)24(25)26/h5-10H,11H2,1-4H3InChIKey
JVQZMBPFDMBRRV-UHFFFAOYSA-NSynonyms
312615-32-0312615320
89dimethoxy55dimethyl3(2nitrophenyl)56dihydro(124)triazolo(34a)isoquinoline
89DIMETHOXY55DIMETHYL3(2NITROPHENYL)6H(124)TRIAZOLO(34A)ISOQUINOLINE
CC1(CC2=CC(=C(C=C2C3=NN=C(N31)C4=CC=CC=C4(N+)(=O)(O))OC)OC)C
COc1cc2c(cc1OC)CC(n1c2nnc1c1ccccc1(N+)(=O)(O))(C)C
InChI=1SC20H20N4O4c120(2)1112916(273)17(284)1014(12)19222118(23(19)20)13756815(13)24(25)26h510H11H214H3
MFCD01536956
ZINC000001299928
ZINC01299928
ZINC1299928
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