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)-N-(naphthalen-1-yl)acetamide
Catalog ID
STK169427
SMILES CCn1c(SCC(=O)Nc2cccc3c2cccc3)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 C27H28N4O2S MW 472.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4O2S/c1-2-31-25(17-33-22-15-14-19-8-3-4-10-21(19)16-22)29-30-27(31)34-18-26(32)28-24-13-7-11-20-9-5-6-12-23(20)24/h5-7,9,11-16H,2-4,8,10,17-18H2,1H3,(H,28,32)InChIKey
AONYKICFCWNUON-UHFFFAOYSA-NSynonyms
2((4ethyl5((5678tetrahydronaphthalen2yloxy)methyl)4H124triazol3yl)sulfanyl)N(naphthalen1yl)acetamide
2((4ethyl5(5678tetrahydronaphthalen2yloxymethyl)124triazol3yl)sulfanyl)Nnaphthalen1ylacetamide
CCN1C(=NN=C1SCC(=O)NC2=CC=CC3=CC=CC=C32)COC4=CC5=C(CCCC5)C=C4
InChI=1SC27H28N4O2Sc123125(1733221514198341021(19)1622)293027(31)341826(32)282413711209561223(20)24h5791116H248101718H21H3(H2832)
MFCD04404014
ZINC000009846992
ZINC09846992
ZINC9846992
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