Vitas-M small molecule compound
3-methyl-7-(3-methylbenzyl)-8-(propan-2-ylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK806195
SMILES CC(Sc1nc2c(n1Cc1cccc(c1)C)c(=O)[nH]c(=O)n2C)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 C17H20N4O2S MW 344.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N4O2S/c1-10(2)24-17-18-14-13(15(22)19-16(23)20(14)4)21(17)9-12-7-5-6-11(3)8-12/h5-8,10H,9H2,1-4H3,(H,19,22,23)InChIKey
KKELBAJFDFZXDG-UHFFFAOYSA-NSynonyms
303973-39-9303973399
3METHYL7((3METHYLPHENYL)METHYL)8PROPAN2YLSULFANYLPURINE26DIONE
3methyl7(3methylbenzyl)8(propan2ylsulfanyl)37dihydro1Hpurine26dione
3METHYL8(METHYLETHYLTHIO)7((3METHYLPHENYL)METHYL)137TRIHYDROPURINE26DIONE
8(ISOPROPYLTHIO)3METHYL7(3METHYLBENZYL)1HPURINE26(3H7H)DIONE
8ISOPROPYLSULFANYL3METHYL7(3METHYLBENZYL)37DIHYDROPURINE26DIONE
CC(Sc1nc2c(n1Cc1cccc(c1)C)c(=O)(nH)c(=O)n2C)C
CC1=CC(=CC=C1)CN2C3=C(N=C2SC(C)C)N(C(=O)NC3=O)C
InChI=1SC17H20N4O2Sc110(2)2417181413(15(22)1916(23)20(14)4)21(17)91275611(3)812h5810H9H214H3(H192223)
MFCD01186378
ZINC000000044052
ZINC00044052
ZINC44052
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