Vitas-M small molecule compound
8-[4-(3-chlorophenyl)piperazin-1-yl]-1,3-dimethyl-7-[2-(pyrimidin-2-ylsulfanyl)ethyl]-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STL001963
SMILES Clc1cccc(c1)N1CCN(CC1)c1nc2c(n1CCSc1ncccn1)c(=O)n(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 C23H25ClN8O2S MW 513.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25ClN8O2S/c1-28-19-18(20(33)29(2)23(28)34)32(13-14-35-21-25-7-4-8-26-21)22(27-19)31-11-9-30(10-12-31)17-6-3-5-16(24)15-17/h3-8,15H,9-14H2,1-2H3InChIKey
SZEKSGNHWXUZIG-UHFFFAOYSA-NSynonyms
844453-10-78(4(3chlorophenyl)piperazin1yl)13dimethyl7(2(pyrimidin2ylsulfanyl)ethyl)37dihydro1Hpurine26dione
8(4(3CHLOROPHENYL)PIPERAZIN1YL)13DIMETHYL7(2(PYRIMIDIN2YLTHIO)ETHYL)1HPURINE26(3H7H)DIONE
8(4(3CHLOROPHENYL)PIPERAZIN1YL)13DIMETHYL7(2PYRIMIDIN2YLSULFANYLETHYL)PURINE26DIONE
8(4(3CHLOROPHENYL)PIPERAZINYL)13DIMETHYL7(2PYRIMIDIN2YLTHIOETHYL)137TRIHYDROPURINE26DIONE
844453107
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCN(CC3)C4=CC(=CC=C4)Cl)CCSC5=NC=CC=N5
InChI=1SC23H25ClN8O2Sc1281918(20(33)29(2)23(28)34)32(13143521257482621)22(2719)3111930(101231)1763516(24)1517h3815H914H212H3
MFCD04157309
ZINC000009089026
ZINC09089026
ZINC9089026
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