Vitas-M small molecule compound
3-[(2-chloro-7H-purin-6-yl)sulfanyl]-1-[4-(2-fluorophenyl)piperazin-1-yl]propan-1-one
Catalog ID
STK623434
SMILES O=C(N1CCN(CC1)c1ccccc1F)CCSc1nc(Cl)nc2c1[nH]cn2
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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 C18H18ClFN6OS MW 420.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClFN6OS/c19-18-23-16-15(21-11-22-16)17(24-18)28-10-5-14(27)26-8-6-25(7-9-26)13-4-2-1-3-12(13)20/h1-4,11H,5-10H2,(H,21,22,23,24)InChIKey
OVJGZWOPXBXCCY-UHFFFAOYSA-NSynonyms
929855-83-43((2chloro7Hpurin6yl)sulfanyl)1(4(2fluorophenyl)piperazin1yl)propan1one
3((2chloro9Hpurin6yl)thio)1(4(2fluorophenyl)piperazin1yl)propan1one
929855834
C1CN(CCN1C2=CC=CC=C2F)C(=O)CCSC3=NC(=NC4=C3NC=N4)Cl
InChI=1SC18H18ClFN6OSc1918231615(21112216)17(2418)2810514(27)268625(7926)13421312(13)20h1411H510H2(H21222324)
MFCD09795943
O=C(N1CCN(CC1)c1ccccc1F)CCSc1nc(Cl)nc2c1(nH)cn2
O=C(N1CCN(CC1)c1ccccc1F)CCSc1nc(Cl)nc2c1nc(nH)2
ZINC000009421343
ZINC09421343
ZINC9421343
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