Vitas-M small molecule compound
7-(4-chlorobenzyl)-8-(3,5-dimethyl-1H-pyrazol-1-yl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK097026
SMILES Clc1ccc(cc1)Cn1c(nc2c1c(=O)[nH]c(=O)n2C)n1nc(cc1C)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 C18H17ClN6O2 MW 384.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17ClN6O2/c1-10-8-11(2)25(22-10)17-20-15-14(16(26)21-18(27)23(15)3)24(17)9-12-4-6-13(19)7-5-12/h4-8H,9H2,1-3H3,(H,21,26,27)InChIKey
HSPNBTLQOQSDGN-UHFFFAOYSA-NSynonyms
305868-69-3305868693
7((4CHLOROPHENYL)METHYL)8(35DIMETHYLPYRAZOL1YL)3METHYLPURINE26DIONE
7(4CHLOROBENZYL)8(35DIMETHYL1HPYRAZOL1YL)3METHYL1HPURINE26(3H7H)DIONE
7(4CHLOROBENZYL)8(35DIMETHYL1HPYRAZOL1YL)3METHYL37DIHYDRO1HPURINE26DIONE
CC1=CC(=NN1C2=NC3=C(N2CC4=CC=C(C=C4)Cl)C(=O)NC(=O)N3C)C
Clc1ccc(cc1)Cn1c(nc2c1c(=O)(nH)c(=O)n2C)n1nc(cc1C)C
InChI=1SC18H17ClN6O2c110811(2)25(2210)17201514(16(26)2118(27)23(15)3)24(17)9124613(19)7512h48H9H213H3(H212627)
MFCD01032139
STK097026
ZINC000000626371
ZINC00626371
ZINC626371
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