Vitas-M small molecule compound
N-[2-(4-ethyl-5-{[2-(3-methoxyphenyl)-2-oxoethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)ethyl]-2-fluorobenzamide
Catalog ID
STK278652
SMILES COc1cccc(c1)C(=O)CSc1nnc(n1CC)CCNC(=O)c1ccccc1F
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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 C22H23FN4O3S MW 442.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23FN4O3S/c1-3-27-20(11-12-24-21(29)17-9-4-5-10-18(17)23)25-26-22(27)31-14-19(28)15-7-6-8-16(13-15)30-2/h4-10,13H,3,11-12,14H2,1-2H3,(H,24,29)InChIKey
JEFZPEGAUODLFT-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)C2=CC(=CC=C2)OC)CCNC(=O)C3=CC=CC=C3F
InChI=1SC22H23FN4O3Sc132720(11122421(29)179451018(17)23)252622(27)311419(28)1576816(1315)302h41013H3111214H212H3(H2429)
MFCD09269439
N(2(4ETHYL5((2(3METHOXYPHENYL)2OXOETHYL)SULFANYL)4H124TRIAZOL3YL)ETHYL)2FLUOROBENZAMIDE
N(2(4ethyl5(2(3methoxyphenyl)2oxoethyl)sulfanyl124triazol3yl)ethyl)2fluorobenzamide
ZINC000009095793
ZINC09095793
ZINC9095793
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