Vitas-M small molecule compound
4-{[(4-ethyl-5-{[(1-methylnaphthalen-2-yl)oxy]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}benzonitrile
Catalog ID
STK278645
SMILES N#Cc1ccc(cc1)C(=O)CSc1nnc(n1CC)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 C25H22N4O2S MW 442.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N4O2S/c1-3-29-24(15-31-23-13-12-19-6-4-5-7-21(19)17(23)2)27-28-25(29)32-16-22(30)20-10-8-18(14-26)9-11-20/h4-13H,3,15-16H2,1-2H3InChIKey
RHLWSVYUPLMXDL-UHFFFAOYSA-NSynonyms
4(((4ETHYL5(((1METHYLNAPHTHALEN2YL)OXY)METHYL)4H124TRIAZOL3YL)SULFANYL)ACETYL)BENZONITRILE
4(2((4ethyl5((1methylnaphthalen2yl)oxymethyl)124triazol3yl)sulfanyl)acetyl)benzonitrile
CCN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)C#N)COC3=C(C4=CC=CC=C4C=C3)C
InChI=1SC25H22N4O2Sc132924(153123131219645721(19)17(23)2)272825(29)321622(30)2010818(1426)91120h413H31516H212H3
MFCD09269432
ZINC000009095786
ZINC09095786
ZINC9095786
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