Vitas-M small molecule compound
8-[(2-hydroxyethyl)sulfanyl]-3-methyl-7-(3-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK806231
SMILES OCCSc1nc2c(n1Cc1cccc(c1)C)c(=O)[nH]c(=O)n2C
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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 C16H18N4O3S MW 346.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N4O3S/c1-10-4-3-5-11(8-10)9-20-12-13(17-16(20)24-7-6-21)19(2)15(23)18-14(12)22/h3-5,8,21H,6-7,9H2,1-2H3,(H,18,22,23)InChIKey
MSGGCOKSMZFRJC-UHFFFAOYSA-NSynonyms
303973-41-3303973413
8((2hydroxyethyl)sulfanyl)3methyl7(3methylbenzyl)37dihydro1Hpurine26dione
8((2HYDROXYETHYL)THIO)3METHYL7(3METHYLBENZYL)1HPURINE26(3H7H)DIONE
8(2HYDROXYETHYLSULFANYL)3METHYL7((3METHYLPHENYL)METHYL)PURINE26DIONE
8(2HYDROXYETHYLTHIO)3METHYL7((3METHYLPHENYL)METHYL)137TRIHYDROPURINE26DIONE
CC1=CC(=CC=C1)CN2C3=C(N=C2SCCO)N(C(=O)NC3=O)C
InChI=1SC16H18N4O3Sc11043511(810)9201213(1716(20)247621)19(2)15(23)1814(12)22h35821H679H212H3(H182223)
MFCD01186392
OCCSc1nc2c(n1Cc1cccc(c1)C)c(=O)(nH)c(=O)n2C
ZINC000002344777
ZINC02344777
ZINC2344777
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