Vitas-M small molecule compound
7-(2-chlorobenzyl)-8-[(3-chloro-2-hydroxypropyl)sulfanyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK805581
SMILES ClCC(CSc1nc2c(n1Cc1ccccc1Cl)c(=O)[nH]c(=O)n2C)O
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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 C16H16Cl2N4O3S MW 415.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16Cl2N4O3S/c1-21-13-12(14(24)20-15(21)25)22(7-9-4-2-3-5-11(9)18)16(19-13)26-8-10(23)6-17/h2-5,10,23H,6-8H2,1H3,(H,20,24,25)InChIKey
APCGIMCQBPXHPS-UHFFFAOYSA-NSynonyms
331841-46-4331841464
7(2chlorobenzyl)8((3chloro2hydroxypropyl)sulfanyl)3methyl37dihydro1Hpurine26dione
8((3chloro2hydroxypropyl)thio)7(2chlorobenzyl)3methyl1Hpurine26(3H7H)dione
8(3CHLORO2HYDROXYPROPYL)SULFANYL7((2CHLOROPHENYL)METHYL)3METHYLPURINE26DIONE
8(3CHLORO2HYDROXYPROPYLTHIO)7((2CHLOROPHENYL)METHYL)3METHYL137TRIHYDROPURINE26DIONE
ClCC(CSc1nc2c(n1Cc1ccccc1Cl)c(=O)(nH)c(=O)n2C)O
CN1C2=C(C(=O)NC1=O)N(C(=N2)SCC(CCl)O)CC3=CC=CC=C3Cl
InChI=1SC16H16Cl2N4O3Sc1211312(14(24)2015(21)25)22(79423511(9)18)16(1913)26810(23)617h251023H68H21H3(H202425)
MFCD01051719
ZINC000000728233
ZINC000000728235
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