Vitas-M small molecule compound
7-[(2E)-but-2-en-1-yl]-8-(3,5-dimethyl-1H-pyrazol-1-yl)-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Catalog ID
STL315978
SMILES C/C=C/Cn1c(nc2c1c(O)nc(=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 C15H18N6O2 MW 314.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H18N6O2/c1-5-6-7-20-11-12(19(4)15(23)17-13(11)22)16-14(20)21-10(3)8-9(2)18-21/h5-6,8H,7H2,1-4H3,(H,17,22,23)/b6-5+InChIKey
SYCZNWQQHREXLZ-AATRIKPKSA-NSynonyms
1014072-91-31014072913
7((2E)but2en1yl)8(35dimethyl1Hpyrazol1yl)6hydroxy3methyl37dihydro2Hpurin2one
7((E)but2enyl)8(35dimethylpyrazol1yl)3methylpurine26dione
CC=CCn1c(nc2c1c(O)nc(=O)n2C)n1nc(cc1C)C
CC=CCN1C2=C(N=C1N3C(=CC(=N3)C)C)N(C(=O)NC2=O)C
InChI=1SC15H18N6O2c1567201112(19(4)15(23)1713(11)22)1614(20)2110(3)89(2)1821h568H7H214H3(H172223)b65+
MFCD28027559
ZINC000012515931
ZINC12515931
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