Vitas-M small molecule compound
8-[(2,3-dihydroxypropyl)sulfanyl]-3-methyl-7-(3-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK806203
SMILES OCC(CSc1nc2c(n1Cc1cccc(c1)C)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 C17H20N4O4S MW 376.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N4O4S/c1-10-4-3-5-11(6-10)7-21-13-14(20(2)16(25)19-15(13)24)18-17(21)26-9-12(23)8-22/h3-6,12,22-23H,7-9H2,1-2H3,(H,19,24,25)InChIKey
MECHKYLMRXSALE-UHFFFAOYSA-NSynonyms
303973-47-9303973479
8((23dihydroxypropyl)sulfanyl)3methyl7(3methylbenzyl)37dihydro1Hpurine26dione
8((23dihydroxypropyl)thio)3methyl7(3methylbenzyl)1Hpurine26(3H7H)dione
8(23DIHYDROXYPROPYLSULFANYL)3METHYL7((3METHYLPHENYL)METHYL)PURINE26DIONE
8(23DIHYDROXYPROPYLTHIO)3METHYL7((3METHYLPHENYL)METHYL)137TRIHYDROPURINE26DIONE
CC1=CC(=CC=C1)CN2C3=C(N=C2SCC(CO)O)N(C(=O)NC3=O)C
InChI=1SC17H20N4O4Sc11043511(610)7211314(20(2)16(25)1915(13)24)1817(21)26912(23)822h36122223H79H212H3(H192425)
MFCD01186413
OCC(CSc1nc2c(n1Cc1cccc(c1)C)c(=O)(nH)c(=O)n2C)O
ZINC000000839517
ZINC000000839520
ZINC00839517
ZINC00839520
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