Vitas-M small molecule compound
2-({4-ethyl-5-[(5,6,7,8-tetrahydronaphthalen-2-yloxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-1-(morpholin-4-yl)ethanone
Catalog ID
STK498127
SMILES CCn1c(nnc1SCC(=O)N1CCOCC1)COc1ccc2c(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 C21H28N4O3S MW 416.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N4O3S/c1-2-25-19(14-28-18-8-7-16-5-3-4-6-17(16)13-18)22-23-21(25)29-15-20(26)24-9-11-27-12-10-24/h7-8,13H,2-6,9-12,14-15H2,1H3InChIKey
ANMAFDLAEQCOQU-UHFFFAOYSA-NSynonyms
2((4ethyl5((5678tetrahydronaphthalen2yloxy)methyl)4H124triazol3yl)sulfanyl)1(morpholin4yl)ethanone
2((4ethyl5(5678tetrahydronaphthalen2yloxymethyl)124triazol3yl)sulfanyl)1morpholin4ylethanone
CCN1C(=NN=C1SCC(=O)N2CCOCC2)COC3=CC4=C(CCCC4)C=C3
InChI=1SC21H28N4O3Sc122519(1428188716534617(16)1318)222321(25)291520(26)2491127121024h7813H269121415H21H3
MFCD11855297
ZINC000032579563
ZINC32579563
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