Vitas-M small molecule compound
8-[benzyl(methyl)amino]-1,3-dimethyl-7-[2-(pyrimidin-2-ylsulfanyl)ethyl]-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK851867
SMILES CN(c1nc2c(n1CCSc1ncccn1)c(=O)n(c(=O)n2C)C)Cc1ccccc1
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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 C21H23N7O2S MW 437.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N7O2S/c1-25(14-15-8-5-4-6-9-15)20-24-17-16(18(29)27(3)21(30)26(17)2)28(20)12-13-31-19-22-10-7-11-23-19/h4-11H,12-14H2,1-3H3InChIKey
PWYPNUCUNLAZFU-UHFFFAOYSA-NSynonyms
839680-99-813DIMETHYL8(METHYLBENZYLAMINO)7(2PYRIMIDIN2YLTHIOETHYL)137TRIHYDROPURINE26DIONE
8(benzyl(methyl)amino)13dimethyl7(2(pyrimidin2ylsulfanyl)ethyl)37dihydro1Hpurine26dione
8(BENZYL(METHYL)AMINO)13DIMETHYL7(2(PYRIMIDIN2YLTHIO)ETHYL)1HPURINE26(3H7H)DIONE
8(BENZYL(METHYL)AMINO)13DIMETHYL7(2PYRIMIDIN2YLSULFANYLETHYL)PURINE26DIONE
839680998
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N(C)CC3=CC=CC=C3)CCSC4=NC=CC=N4
InChI=1SC21H23N7O2Sc125(14158546915)20241716(18(29)27(3)21(30)26(17)2)28(20)1213311922107112319h411H1214H213H3
MFCD04456974
ZINC000006529330
ZINC06529330
ZINC6529330
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