Vitas-M small molecule compound
1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-{[4-ethyl-5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Catalog ID
STK289096
SMILES CCn1c(SCC(=O)N2CCc3c(C2)cccc3)nnc1c1ccc(cc1)F
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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 C21H21FN4OS MW 396.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21FN4OS/c1-2-26-20(16-7-9-18(22)10-8-16)23-24-21(26)28-14-19(27)25-12-11-15-5-3-4-6-17(15)13-25/h3-10H,2,11-14H2,1H3InChIKey
GUXNDAIKJRTPCA-UHFFFAOYSA-NSynonyms
1(34dihydro1Hisoquinolin2yl)2((4ethyl5(4fluorophenyl)124triazol3yl)sulfanyl)ethanone
1(34dihydroisoquinolin2(1H)yl)2((4ethyl5(4fluorophenyl)4H124triazol3yl)sulfanyl)ethanone
CCN1C(=NN=C1SCC(=O)N2CCC3=CC=CC=C3C2)C4=CC=C(C=C4)F
InChI=1SC21H21FN4OSc122620(167918(22)10816)232421(26)281419(27)25121115534617(15)1325h310H21114H21H3
MFCD09039683
ZINC000013519577
ZINC13519577
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