Vitas-M small molecule compound
7-(3-bromobenzyl)-6-hydroxy-3-methyl-8-{[2-(4-nitrophenyl)-2-oxoethyl]sulfanyl}-3,7-dihydro-2H-purin-2-one
Catalog ID
STK631620
SMILES Brc1cccc(c1)Cn1c(SCC(=O)c2ccc(cc2)[N+](=O)[O-])nc2c1c(O)nc(=O)n2C
Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.
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 C21H16BrN5O5S MW 530.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16BrN5O5S/c1-25-18-17(19(29)24-20(25)30)26(10-12-3-2-4-14(22)9-12)21(23-18)33-11-16(28)13-5-7-15(8-6-13)27(31)32/h2-9H,10-11H2,1H3,(H,24,29,30)InChIKey
IIVGJEFIMUCZRW-UHFFFAOYSA-NSynonyms
326919-00-0326919000
7((3BROMOPHENYL)METHYL)3METHYL8(2(4NITROPHENYL)2OXOETHYL)SULFANYLPURINE26DIONE
7((3BROMOPHENYL)METHYL)3METHYL8(2(4NITROPHENYL)2OXOETHYLTHIO)137TRIHYDROPURINE26DIONE
7(3bromobenzyl)6hydroxy3methyl8((2(4nitrophenyl)2oxoethyl)sulfanyl)37dihydro2Hpurin2one
Brc1cccc(c1)Cn1c(SCC(=O)c2ccc(cc2)(N+)(=O)(O))nc2c1c(O)nc(=O)n2C
CN1C2=C(C(=O)NC1=O)N(C(=N2)SCC(=O)C3=CC=C(C=C3)(N+)(=O)(O))CC4=CC(=CC=C4)Br
InChI=1SC21H16BrN5O5Sc1251817(19(29)2420(25)30)26(101232414(22)912)21(2318)331116(28)135715(8613)27(31)32h29H1011H21H3(H242930)
MFCD18159523
ZINC000008642808
ZINC8642808
Check stock
See real-time availability and sample size for STK631620 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.