Vitas-M small molecule compound
2-(5-{[2-(4-cyanophenyl)-2-oxoethyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)-N-(4-fluorophenyl)acetamide
Catalog ID
STK245875
SMILES N#Cc1ccc(cc1)C(=O)CSc1nnc(n1CC)CC(=O)Nc1ccc(cc1)F
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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 C21H18FN5O2S MW 423.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18FN5O2S/c1-2-27-19(11-20(29)24-17-9-7-16(22)8-10-17)25-26-21(27)30-13-18(28)15-5-3-14(12-23)4-6-15/h3-10H,2,11,13H2,1H3,(H,24,29)InChIKey
OQOBORCSHCMDBI-UHFFFAOYSA-NSynonyms
2(5((2(4CYANOPHENYL)2OXOETHYL)SULFANYL)4ETHYL4H124TRIAZOL3YL)N(4FLUOROPHENYL)ACETAMIDE
2(5(2(4cyanophenyl)2oxoethyl)sulfanyl4ethyl124triazol3yl)N(4fluorophenyl)acetamide
2(5(2(4CYANOPHENYL)2OXOETHYLSULFANYL)4ETHYL4H(124)TRIAZOL3YL)N(4FLUOROPHENYL)ACETAMIDE
CCN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)C#N)CC(=O)NC3=CC=C(C=C3)F
InChI=1SC21H18FN5O2Sc122719(1120(29)24179716(22)81017)252621(27)301318(28)155314(1223)4615h310H21113H21H3(H2429)
MFCD08670645
ZINC000009328356
ZINC09328356
ZINC9328356
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