Vitas-M small molecule compound
2-{[2-(8-bromo-6-hydroxy-3-methyl-2-oxo-2,3-dihydro-7H-purin-7-yl)ethyl]sulfanyl}-N-phenylacetamide
Catalog ID
STL147385
SMILES O=C(Nc1ccccc1)CSCCn1c(Br)nc2c1c(O)nc(=O)n2C
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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 C16H16BrN5O3S MW 438.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16BrN5O3S/c1-21-13-12(14(24)20-16(21)25)22(15(17)19-13)7-8-26-9-11(23)18-10-5-3-2-4-6-10/h2-6H,7-9H2,1H3,(H,18,23)(H,20,24,25)InChIKey
ZMVQAAWWNRSSOO-UHFFFAOYSA-NSynonyms
476481-78-42((2(8BROMO3METHYL26DIOXO23DIHYDRO1HPURIN7(6H)YL)ETHYL)THIO)NPHENYLACETAMIDE
2((2(8bromo6hydroxy3methyl2oxo23dihydro7Hpurin7yl)ethyl)sulfanyl)Nphenylacetamide
2(2(8BROMO3METHYL26DIOXO(137TRIHYDROPURIN7YL))ETHYLTHIO)NPHENYLACETAMIDE
2(2(8BROMO3METHYL26DIOXOPURIN7YL)ETHYLSULFANYL)NPHENYLACETAMIDE
476481784
CN1C2=C(C(=O)NC1=O)N(C(=N2)Br)CCSCC(=O)NC3=CC=CC=C3
InChI=1SC16H16BrN5O3Sc1211312(14(24)2016(21)25)22(15(17)1913)7826911(23)18105324610h26H79H21H3(H1823)(H202425)
MFCD03802766
ZINC000001786285
ZINC01786285
ZINC1786285
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