Vitas-M small molecule compound
2-[(2-chloro-7H-purin-6-yl)amino]-1-(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)ethanone
Catalog ID
STK628019
SMILES O=C(N1CC2(CC1CC(C2)(C)C)C)CNc1nc(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 C17H23ClN6O MW 362.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H23ClN6O/c1-16(2)4-10-5-17(3,7-16)8-24(10)11(25)6-19-13-12-14(21-9-20-12)23-15(18)22-13/h9-10H,4-8H2,1-3H3,(H2,19,20,21,22,23)InChIKey
PRRJOVWQRHBSCT-UHFFFAOYSA-NSynonyms
929864-68-62((2chloro7Hpurin6yl)amino)1(133trimethyl6azabicyclo(321)oct6yl)ethanone
2((2chloro7Hpurin6yl)amino)1(335trimethyl7azabicyclo(321)octan7yl)ethanone
2((2chloro9Hpurin6yl)amino)1(133trimethyl6azabicyclo(321)octan6yl)ethanone
929864686
CC1(CC2CC(C1)(CN2C(=O)CNC3=NC(=NC4=C3NC=N4)Cl)C)C
InChI=1SC17H23ClN6Oc116(2)410517(3716)824(10)11(25)619131214(2192012)2315(18)2213h910H48H213H3(H21920212223)
MFCD09790676
O=C(N1CC2(CC1CC(C2)(C)C)C)CNc1nc(Cl)nc2c1(nH)cn2
O=C(N1CC2(CC1CC(C2)(C)C)C)CNc1nc(Cl)nc2c1nc(nH)2
ZINC000101480187
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