Vitas-M small molecule compound
8-(4-benzylpiperazin-1-yl)-6-hydroxy-3-methyl-7-[3-(pyrimidin-2-ylsulfanyl)propyl]-3,7-dihydro-2H-purin-2-one
Catalog ID
STL051966
SMILES O=c1nc(O)c2c(n1C)nc(n2CCCSc1ncccn1)N1CCN(CC1)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 C24H28N8O2S MW 492.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N8O2S/c1-29-20-19(21(33)28-24(29)34)32(11-6-16-35-22-25-9-5-10-26-22)23(27-20)31-14-12-30(13-15-31)17-18-7-3-2-4-8-18/h2-5,7-10H,6,11-17H2,1H3,(H,28,33,34)InChIKey
CTTYLIXHSOOEJS-UHFFFAOYSA-NSynonyms
714926-14-43METHYL8(4BENZYLPIPERAZINYL)7(3PYRIMIDIN2YLTHIOPROPYL)137TRIHYDROPURINE26DIONE
714926144
8(4BENZYLPIPERAZIN1YL)3METHYL7(3PYRIMIDIN2YLSULFANYLPROPYL)PURINE26DIONE
8(4benzylpiperazin1yl)6hydroxy3methyl7(3(pyrimidin2ylsulfanyl)propyl)37dihydro2Hpurin2one
CN1C2=C(C(=O)NC1=O)N(C(=N2)N3CCN(CC3)CC4=CC=CC=C4)CCCSC5=NC=CC=N5
InChI=1SC24H28N8O2Sc1292019(21(33)2824(29)34)32(1161635222595102622)23(2720)31141230(131531)17187324818h25710H61117H21H3(H283334)
MFCD05733770
ZINC000061932203
ZINC61932203
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