Vitas-M small molecule compound
8-[(2-chloro-6-fluorobenzyl)sulfanyl]-1,3-dimethyl-7-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STL332590
SMILES CC(CCn1c(SCc2c(F)cccc2Cl)nc2c1c(=O)n(c(=O)n2C)C)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 C19H22ClFN4O2S MW 424.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22ClFN4O2S/c1-11(2)8-9-25-15-16(23(3)19(27)24(4)17(15)26)22-18(25)28-10-12-13(20)6-5-7-14(12)21/h5-7,11H,8-10H2,1-4H3InChIKey
BKYVHUAYFYLPDN-UHFFFAOYSA-NSynonyms
371117-69-0371117690
8((2chloro6fluorobenzyl)sulfanyl)13dimethyl7(3methylbutyl)37dihydro1Hpurine26dione
8((2chloro6fluorobenzyl)thio)7isopentyl13dimethyl1Hpurine26(3H7H)dione
8((2CHLORO6FLUOROPHENYL)METHYLSULFANYL)13DIMETHYL7(3METHYLBUTYL)PURINE26DIONE
CC(C)CCN1C2=C(N=C1SCC3=C(C=CC=C3Cl)F)N(C(=O)N(C2=O)C)C
InChI=1SC19H22ClFN4O2Sc111(2)89251516(23(3)19(27)24(4)17(15)26)2218(25)28101213(20)65714(12)21h5711H810H214H3
MFCD03007614
ZINC000009110970
ZINC09110970
ZINC9110970
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