Vitas-M small molecule compound
N-(2,5-dimethylphenyl)-2-(4-ethyl-5-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)acetamide
Catalog ID
STK497625
SMILES CCn1c(SCC(=O)c2ccc(cc2)F)nnc1CC(=O)Nc1cc(C)ccc1C
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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 C22H23FN4O2S MW 426.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23FN4O2S/c1-4-27-20(12-21(29)24-18-11-14(2)5-6-15(18)3)25-26-22(27)30-13-19(28)16-7-9-17(23)10-8-16/h5-11H,4,12-13H2,1-3H3,(H,24,29)InChIKey
UFABRULXAGEJBJ-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)F)CC(=O)NC3=C(C=CC(=C3)C)C
InChI=1SC22H23FN4O2Sc142720(1221(29)24181114(2)5615(18)3)252622(27)301319(28)167917(23)10816h511H41213H213H3(H2429)
MFCD11855006
N(25dimethylphenyl)2(4ethyl5((2(4fluorophenyl)2oxoethyl)sulfanyl)4H124triazol3yl)acetamide
N(25dimethylphenyl)2(4ethyl5(2(4fluorophenyl)2oxoethyl)sulfanyl124triazol3yl)acetamide
ZINC000032579369
ZINC32579369
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