Vitas-M small molecule compound
2-({5-[(2,6-dimethylphenoxy)methyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-fluorophenyl)acetamide
Catalog ID
STK218976
SMILES CCn1c(SCC(=O)Nc2cccc(c2)F)nnc1COc1c(C)cccc1C
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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 C21H23FN4O2S MW 414.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23FN4O2S/c1-4-26-18(12-28-20-14(2)7-5-8-15(20)3)24-25-21(26)29-13-19(27)23-17-10-6-9-16(22)11-17/h5-11H,4,12-13H2,1-3H3,(H,23,27)InChIKey
XSFPEBJGUSNVPU-UHFFFAOYSA-NSynonyms
2((5((26DIMETHYLPHENOXY)METHYL)4ETHYL124TRIAZOL3YL)SULFANYL)N(3FLUOROPHENYL)ACETAMIDE
2((5((26DIMETHYLPHENOXY)METHYL)4ETHYL4H124TRIAZOL3YL)SULFANYL)N(3FLUOROPHENYL)ACETAMIDE
CCN1C(=NN=C1SCC(=O)NC2=CC(=CC=C2)F)COC3=C(C=CC=C3C)C
InChI=1SC21H23FN4O2Sc142618(12282014(2)75815(20)3)242521(26)291319(27)2317106916(22)1117h511H41213H213H3(H2327)
MFCD06000668
ZINC000002868758
ZINC02868758
ZINC2868758
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