Vitas-M small molecule compound
2-{[5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-[4-(pyridin-2-yl)piperazin-1-yl]ethanone
Catalog ID
STK361578
SMILES COc1ccc(cc1)c1nnc([nH]1)SCC(=O)N1CCN(CC1)c1ccccn1
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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 C20H22N6O2S MW 410.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N6O2S/c1-28-16-7-5-15(6-8-16)19-22-20(24-23-19)29-14-18(27)26-12-10-25(11-13-26)17-4-2-3-9-21-17/h2-9H,10-14H2,1H3,(H,22,23,24)InChIKey
RTRGKNRQWMXINI-UHFFFAOYSA-NSynonyms
2((5(4METHOXYPHENYL)1H124TRIAZOL3YL)SULFANYL)1(4PYRIDIN2YLPIPERAZIN1YL)ETHANONE
2((5(4methoxyphenyl)4H124triazol3yl)sulfanyl)1(4(pyridin2yl)piperazin1yl)ethanone
COC1=CC=C(C=C1)C2=NC(=NN2)SCC(=O)N3CCN(CC3)C4=CC=CC=N4
COc1ccc(cc1)c1nnc((nH)1)SCC(=O)N1CCN(CC1)c1ccccn1
InChI=1SC20H22N6O2Sc128167515(6816)192220(242319)291418(27)26121025(111326)1742392117h29H1014H21H3(H222324)
MFCD11852728
ZINC000007020842
ZINC7020842
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