Vitas-M small molecule compound
1-(1,3-benzodioxol-5-yl)-2-{[4-(4-methylpiperazin-1-yl)pyrimidin-2-yl]sulfanyl}ethanone
Catalog ID
STL033052
SMILES CN1CCN(CC1)c1ccnc(n1)SCC(=O)c1ccc2c(c1)OCO2
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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 C18H20N4O3S MW 372.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N4O3S/c1-21-6-8-22(9-7-21)17-4-5-19-18(20-17)26-11-14(23)13-2-3-15-16(10-13)25-12-24-15/h2-5,10H,6-9,11-12H2,1H3InChIKey
RNFPGBQGCSTLOR-UHFFFAOYSA-NSynonyms
941252-60-41(13benzodioxol5yl)2((4(4methylpiperazin1yl)pyrimidin2yl)sulfanyl)ethanone
1(13benzodioxol5yl)2(4(4methylpiperazin1yl)pyrimidin2yl)sulfanylethanone
1(2HBENZO(34D)13DIOXOLEN5YL)2(4(4METHYLPIPERAZINYL)PYRIMIDIN2YLTHIO)ETHAN1ONE
1(BENZO(D)(13)DIOXOL5YL)2((4(4METHYLPIPERAZIN1YL)PYRIMIDIN2YL)THIO)ETHANONE
941252604
CN1CCN(CC1)C2=NC(=NC=C2)SCC(=O)C3=CC4=C(C=C3)OCO4
InChI=1SC18H20N4O3Sc1216822(9721)17451918(2017)261114(23)13231516(1013)25122415h2510H691112H21H3
MFCD09761150
ZINC000012249818
ZINC12249818
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