Vitas-M small molecule compound
1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-{[4-ethyl-5-(7-methoxy-1-benzofuran-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Catalog ID
STK245641
SMILES COc1cccc2c1oc(c2)c1nnc(n1CC)SCC(=O)N1CCc2c(C1)cccc2
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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 C24H24N4O3S MW 448.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24N4O3S/c1-3-28-23(20-13-17-9-6-10-19(30-2)22(17)31-20)25-26-24(28)32-15-21(29)27-12-11-16-7-4-5-8-18(16)14-27/h4-10,13H,3,11-12,14-15H2,1-2H3InChIKey
LYWLCMKUYVCOIE-UHFFFAOYSA-NSynonyms
1(34dihydro1Hisoquinolin2yl)2((4ethyl5(7methoxy1benzofuran2yl)124triazol3yl)sulfanyl)ethanone
1(34DIHYDRO1HISOQUINOLIN2YL)2(4ETHYL5(7METHOXYBENZOFURAN2YL)4H(124)TRIAZOL3YLSULFANYL)ETHANONE
1(34DIHYDROISOQUINOLIN2(1H)YL)2((4ETHYL5(7METHOXY1BENZOFURAN2YL)4H124TRIAZOL3YL)SULFANYL)ETHANONE
CCN1C(=NN=C1SCC(=O)N2CCC3=CC=CC=C3C2)C4=CC5=C(O4)C(=CC=C5)OC
InChI=1SC24H24N4O3Sc132823(201317961019(302)22(17)3120)252624(28)321521(29)27121116745818(16)1427h41013H311121415H212H3
MFCD08670288
ZINC000009327715
ZINC09327715
ZINC9327715
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