Vitas-M small molecule compound
N-(4-bromo-2-fluorophenyl)-2-[(2,6-diethyl-7-oxo-6,7-dihydro-2H-pyrazolo[4,3-d]pyrimidin-5-yl)sulfanyl]acetamide
Catalog ID
STL402622
SMILES CCn1c(SCC(=O)Nc2ccc(cc2F)Br)nc2c(c1=O)nn(c2)CC
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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 C17H17BrFN5O2S MW 454.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17BrFN5O2S/c1-3-23-8-13-15(22-23)16(26)24(4-2)17(21-13)27-9-14(25)20-12-6-5-10(18)7-11(12)19/h5-8H,3-4,9H2,1-2H3,(H,20,25)InChIKey
SZKVCAJCODHFLY-UHFFFAOYSA-NSynonyms
832745-43-4832745434
CCN1C=C2C(=N1)C(=O)N(C(=N2)SCC(=O)NC3=C(C=C(C=C3)Br)F)CC
InChI=1SC17H17BrFN5O2Sc132381315(2223)16(26)24(42)17(2113)27914(25)20126510(18)711(12)19h58H349H212H3(H2025)
MFCD05667394
N(4bromo2fluorophenyl)2((26diethyl7oxo67dihydro2Hpyrazolo(43d)pyrimidin5yl)sulfanyl)acetamide
N(4bromo2fluorophenyl)2(26diethyl7oxopyrazolo(43d)pyrimidin5yl)sulfanylacetamide
ZINC000002732945
ZINC02732945
ZINC2732945
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