Vitas-M small molecule compound
2-[(2-chloro-7H-purin-6-yl)sulfanyl]-1-[4-(2-methoxyphenyl)piperazin-1-yl]propan-1-one
Catalog ID
STK618503
SMILES COc1ccccc1N1CCN(CC1)C(=O)C(Sc1nc(Cl)nc2c1[nH]cn2)C
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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 C19H21ClN6O2S MW 432.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21ClN6O2S/c1-12(29-17-15-16(22-11-21-15)23-19(20)24-17)18(27)26-9-7-25(8-10-26)13-5-3-4-6-14(13)28-2/h3-6,11-12H,7-10H2,1-2H3,(H,21,22,23,24)InChIKey
ZMUQLAQEEUTQDA-UHFFFAOYSA-NSynonyms
929862-28-22((2chloro7Hpurin6yl)sulfanyl)1(4(2methoxyphenyl)piperazin1yl)propan1one
2((2chloro9Hpurin6yl)thio)1(4(2methoxyphenyl)piperazin1yl)propan1one
929862282
CC(C(=O)N1CCN(CC1)C2=CC=CC=C2OC)SC3=NC(=NC4=C3NC=N4)Cl
COc1ccccc1N1CCN(CC1)C(=O)C(Sc1nc(Cl)nc2c1(nH)cn2)C
COc1ccccc1N1CCN(CC1)C(=O)C(Sc1nc(Cl)nc2c1nc(nH)2)C
InChI=1SC19H21ClN6O2Sc112(29171516(22112115)2319(20)2417)18(27)269725(81026)13534614(13)282h361112H710H212H3(H21222324)
MFCD09793713
ZINC000009421604
ZINC000009421605
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