Vitas-M small molecule compound
1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-{[4-methyl-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Catalog ID
STK256746
SMILES O=C(N1CCc2c(C1)cccc2)CSc1nnc(n1C)COc1ccccc1
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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 C21H22N4O2S MW 394.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O2S/c1-24-19(14-27-18-9-3-2-4-10-18)22-23-21(24)28-15-20(26)25-12-11-16-7-5-6-8-17(16)13-25/h2-10H,11-15H2,1H3InChIKey
IJIVGIDWKCETDY-UHFFFAOYSA-NSynonyms
1(34dihydro1Hisoquinolin2yl)2((4methyl5(phenoxymethyl)124triazol3yl)sulfanyl)ethanone
1(34DIHYDROISOQUINOLIN2(1H)YL)2((4METHYL5(PHENOXYMETHYL)4H124TRIAZOL3YL)SULFANYL)ETHANONE
CN1C(=NN=C1SCC(=O)N2CCC3=CC=CC=C3C2)COC4=CC=CC=C4
InChI=1SC21H22N4O2Sc12419(14271893241018)222321(24)281520(26)25121116756817(16)1325h210H1115H21H3
MFCD08670292
ZINC000009263516
ZINC09263516
ZINC9263516
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