Vitas-M small molecule compound
1-[4-(2-methoxyphenyl)piperazin-1-yl]-2-{[5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Catalog ID
STK619418
SMILES COc1ccccc1N1CCN(CC1)C(=O)CSc1nnc([nH]1)c1cccnc1
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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/c1-28-17-7-3-2-6-16(17)25-9-11-26(12-10-25)18(27)14-29-20-22-19(23-24-20)15-5-4-8-21-13-15/h2-8,13H,9-12,14H2,1H3,(H,22,23,24)InChIKey
TZEYIDPNZLZQHL-UHFFFAOYSA-NSynonyms
929868-54-21(4(2methoxyphenyl)piperazin1yl)2((5(pyridin3yl)4H124triazol3yl)sulfanyl)ethanone
1(4(2methoxyphenyl)piperazin1yl)2((5(pyridin3yl)4H124triazol3yl)thio)ethanone
1(4(2methoxyphenyl)piperazin1yl)2((5pyridin3yl1H124triazol3yl)sulfanyl)ethanone
929868542
COC1=CC=CC=C1N2CCN(CC2)C(=O)CSC3=NNC(=N3)C4=CN=CC=C4
COc1ccccc1N1CCN(CC1)C(=O)CSc1nnc((nH)1)c1cccnc1
InChI=1SC20H22N6O2Sc12817732616(17)2591126(121025)18(27)1429202219(232420)15548211315h2813H91214H21H3(H222324)
MFCD09847730
ZINC000008990620
ZINC08990620
ZINC8990620
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