Vitas-M small molecule compound
1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-[4-(2-methyl-2H-tetrazol-5-yl)phenoxy]ethanone
Catalog ID
STL410669
SMILES COc1cc2CN(CCc2cc1OC)C(=O)COc1ccc(cc1)c1nnn(n1)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 C21H23N5O4 MW 409.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N5O4/c1-25-23-21(22-24-25)14-4-6-17(7-5-14)30-13-20(27)26-9-8-15-10-18(28-2)19(29-3)11-16(15)12-26/h4-7,10-11H,8-9,12-13H2,1-3H3InChIKey
PBSQPVSELSEEPU-UHFFFAOYSA-NSynonyms
1574530-30-51(67dimethoxy34dihydro1Hisoquinolin2yl)2(4(2methyltetrazol5yl)phenoxy)ethanone
1(67dimethoxy34dihydroisoquinolin2(1H)yl)2(4(2methyl2Htetrazol5yl)phenoxy)ethanone
1574530305
CN1N=C(N=N1)C2=CC=C(C=C2)OCC(=O)N3CCC4=CC(=C(C=C4C3)OC)OC
InChI=1SC21H23N5O4c1252321(222425)144617(7514)301320(27)2698151018(282)19(293)1116(15)1226h471011H891213H213H3
MFCD28058266
ZINC000096224235
ZINC96224235
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