Vitas-M small molecule compound
2-{[4-ethyl-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-fluoro-4-methylphenyl)acetamide
Catalog ID
STK498073
SMILES CCn1c(SCC(=O)Nc2ccc(cc2F)C)nnc1COc1ccccc1
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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 C20H21FN4O2S MW 400.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21FN4O2S/c1-3-25-18(12-27-15-7-5-4-6-8-15)23-24-20(25)28-13-19(26)22-17-10-9-14(2)11-16(17)21/h4-11H,3,12-13H2,1-2H3,(H,22,26)InChIKey
PCGKKIYHMIKCCI-UHFFFAOYSA-NSynonyms
2((4ethyl5(phenoxymethyl)124triazol3yl)sulfanyl)N(2fluoro4methylphenyl)acetamide
2((4ethyl5(phenoxymethyl)4H124triazol3yl)sulfanyl)N(2fluoro4methylphenyl)acetamide
CCN1C(=NN=C1SCC(=O)NC2=C(C=C(C=C2)C)F)COC3=CC=CC=C3
InChI=1SC20H21FN4O2Sc132518(1227157546815)232420(25)281319(26)221710914(2)1116(17)21h411H31213H212H3(H2226)
MFCD11855245
ZINC000032579515
ZINC32579515
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