Vitas-M small molecule compound
1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[(4-methyl-5-{[(1-methylnaphthalen-2-yl)oxy]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]ethanone
Catalog ID
STK245653
SMILES O=C(N1CCc2c(C1)cccc2)CSc1nnc(n1C)COc1ccc2c(c1C)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 C26H26N4O2S MW 458.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N4O2S/c1-18-22-10-6-5-8-20(22)11-12-23(18)32-16-24-27-28-26(29(24)2)33-17-25(31)30-14-13-19-7-3-4-9-21(19)15-30/h3-12H,13-17H2,1-2H3InChIKey
VJWMHPCASVKVGI-UHFFFAOYSA-NSynonyms
1(34dihydro1Hisoquinolin2yl)2((4methyl5((1methylnaphthalen2yl)oxymethyl)124triazol3yl)sulfanyl)ethanone
1(34DIHYDROISOQUINOLIN2(1H)YL)2((4METHYL5(((1METHYLNAPHTHALEN2YL)OXY)METHYL)4H124TRIAZOL3YL)SULFANYL)ETHANONE
CC1=C(C=CC2=CC=CC=C12)OCC3=NN=C(N3C)SCC(=O)N4CCC5=CC=CC=C5C4
InChI=1SC26H26N4O2Sc118221065820(22)111223(18)321624272826(29(24)2)331725(31)30141319734921(19)1530h312H1317H212H3
MFCD08670302
ZINC000009327754
ZINC09327754
ZINC9327754
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