Vitas-M small molecule compound
1-[4-(2,2-dichlorocyclopropyl)phenyl]-2-(9H-purin-6-ylsulfanyl)ethanone
Catalog ID
STK357452
SMILES O=C(c1ccc(cc1)C1CC1(Cl)Cl)CSc1ncnc2c1nc[nH]2
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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 C16H12Cl2N4OS MW 379.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12Cl2N4OS/c17-16(18)5-11(16)9-1-3-10(4-2-9)12(23)6-24-15-13-14(20-7-19-13)21-8-22-15/h1-4,7-8,11H,5-6H2,(H,19,20,21,22)InChIKey
KJHJENFOBFRUJW-UHFFFAOYSA-NSynonyms
948234-00-21(4(22dichlorocyclopropyl)phenyl)2(7Hpurin6ylsulfanyl)ethanone
1(4(22dichlorocyclopropyl)phenyl)2(9Hpurin6ylsulfanyl)ethanone
2((9Hpurin6yl)thio)1(4(22dichlorocyclopropyl)phenyl)ethanone
948234002
C1C(C1(Cl)Cl)C2=CC=C(C=C2)C(=O)CSC3=NC=NC4=C3NC=N4
InChI=1SC16H12Cl2N4OSc1716(18)511(16)91310(429)12(23)624151314(2071913)2182215h147811H56H2(H19202122)
MFCD09857134
O=C(c1ccc(cc1)C1CC1(Cl)Cl)CSc1ncnc2c1nc(nH)2
ZINC000009146232
ZINC000009146233
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