Vitas-M small molecule compound
[5-bromo-2-(1H-tetrazol-1-yl)phenyl](6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methanone
Catalog ID
STK645882
SMILES COc1cc2CCN(Cc2cc1OC)C(=O)c1cc(Br)ccc1n1cnnn1
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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 C19H18BrN5O3 MW 444.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18BrN5O3/c1-27-17-7-12-5-6-24(10-13(12)8-18(17)28-2)19(26)15-9-14(20)3-4-16(15)25-11-21-22-23-25/h3-4,7-9,11H,5-6,10H2,1-2H3InChIKey
WWCLMVRWQJLPLB-UHFFFAOYSA-NSynonyms
1010934-13-0(5bromo2(1Htetrazol1yl)phenyl)(67dimethoxy34dihydroisoquinolin2(1H)yl)methanone
(5bromo2(tetrazol1yl)phenyl)(67dimethoxy34dihydro1Hisoquinolin2yl)methanone
1010934130
COC1=C(C=C2CN(CCC2=C1)C(=O)C3=C(C=CC(=C3)Br)N4C=NN=N4)OC
InChI=1SC19H18BrN5O3c127177125624(1013(12)818(17)282)19(26)15914(20)3416(15)251121222325h347911H5610H212H3
MFCD12199315
ZINC000012321557
ZINC12321557
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