Vitas-M small molecule compound
7-benzyl-8-{[(2Z)-3-chlorobut-2-en-1-yl]sulfanyl}-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK833742
SMILES C/C(=C/CSc1nc2c(n1Cc1ccccc1)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 C17H17ClN4O2S MW 376.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17ClN4O2S/c1-11(18)8-9-25-17-19-14-13(15(23)20-16(24)21(14)2)22(17)10-12-6-4-3-5-7-12/h3-8H,9-10H2,1-2H3,(H,20,23,24)/b11-8-InChIKey
DLMIPWXQBRRCMW-FLIBITNWSA-NSynonyms
301354-26-7(Z)7benzyl8((3chlorobut2en1yl)thio)3methyl1Hpurine26(3H7H)dione
301354267
7benzyl8(((2Z)3chlorobut2en1yl)sulfanyl)3methyl37dihydro1Hpurine26dione
7BENZYL8((Z)3CHLOROBUT2ENYL)SULFANYL3METHYLPURINE26DIONE
CC(=CCSC1=NC2=C(N1CC3=CC=CC=C3)C(=O)NC(=O)N2C)Cl
CC(=CCSc1nc2c(n1Cc1ccccc1)c(=O)(nH)c(=O)n2C)Cl
InChI=1SC17H17ClN4O2Sc111(18)892517191413(15(23)2016(24)21(14)2)22(17)10126435712h38H910H212H3(H202324)b118
MFCD00994181
ZINC000000725558
ZINC00725558
ZINC725558
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