Vitas-M small molecule compound
1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-({4-ethyl-5-[(5,6,7,8-tetrahydronaphthalen-2-yloxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)ethanone
Catalog ID
STK251277
SMILES CCn1c(SCC(=O)N2CCc3c(C2)cccc3)nnc1COc1ccc2c(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 C26H30N4O2S MW 462.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N4O2S/c1-2-30-24(17-32-23-12-11-19-7-3-5-9-21(19)15-23)27-28-26(30)33-18-25(31)29-14-13-20-8-4-6-10-22(20)16-29/h4,6,8,10-12,15H,2-3,5,7,9,13-14,16-18H2,1H3InChIKey
QZDWRXVQTZWYRK-UHFFFAOYSA-NSynonyms
1(34dihydro1Hisoquinolin2yl)2((4ethyl5(5678tetrahydronaphthalen2yloxymethyl)124triazol3yl)sulfanyl)ethanone
1(34dihydroisoquinolin2(1H)yl)2((4ethyl5((5678tetrahydronaphthalen2yloxy)methyl)4H124triazol3yl)sulfanyl)ethanone
CCN1C(=NN=C1SCC(=O)N2CCC3=CC=CC=C3C2)COC4=CC5=C(CCCC5)C=C4
InChI=1SC26H30N4O2Sc123024(173223121119735921(19)1523)272826(30)331825(31)291413208461022(20)1629h468101215H2357913141618H21H3
MFCD08670420
ZINC000009699072
ZINC09699072
ZINC9699072
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