Vitas-M small molecule compound
8-{[(2Z)-3-chlorobut-2-en-1-yl]sulfanyl}-3-methyl-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK095544
SMILES C/C(=C/CSc1nc2c(n1CCc1ccccc1)c(=O)[nH]c(=O)n2C)/Cl
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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 C18H19ClN4O2S MW 390.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19ClN4O2S/c1-12(19)9-11-26-18-20-15-14(16(24)21-17(25)22(15)2)23(18)10-8-13-6-4-3-5-7-13/h3-7,9H,8,10-11H2,1-2H3,(H,21,24,25)/b12-9-InChIKey
XVOTWNGFBFPKMV-XFXZXTDPSA-NSynonyms
332149-59-4(Z)8((3chlorobut2en1yl)thio)3methyl7phenethyl1Hpurine26(3H7H)dione
332149594
8(((2Z)3CHLOROBUT2EN1YL)SULFANYL)3METHYL7(2PHENYLETHYL)37DIHYDRO1HPURINE26DIONE
8((2Z)3CHLOROBUT2ENYLTHIO)3METHYL7(2PHENYLETHYL)137TRIHYDROPURINE26DIONE
8((3CHLORO2BUTENYL)SULFANYL)3METHYL7(2PHENYLETHYL)37DIHYDRO1HPURINE26DIONE
8((Z)3chlorobut2enyl)sulfanyl3methyl7(2phenylethyl)purine26dione
8((Z)3CHLOROBUT2ENYL)SULFANYL3METHYL7PHENETHYLPURINE26DIONE
CC(=CCSC1=NC2=C(N1CCC3=CC=CC=C3)C(=O)NC(=O)N2C)Cl
CC(=CCSc1nc2c(n1CCc1ccccc1)c(=O)(nH)c(=O)n2C)Cl
InChI=1SC18H19ClN4O2Sc112(19)9112618201514(16(24)2117(25)22(15)2)23(18)108136435713h379H81011H212H3(H212425)b129
MFCD01142755
STK095544
ZINC000000827954
ZINC00827954
ZINC827954
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