Vitas-M small molecule compound
8-[(2-chlorobenzyl)sulfanyl]-7-[(2Z)-3-chlorobut-2-en-1-yl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK022983
SMILES C/C(=C/Cn1c(SCc2ccccc2Cl)nc2c1c(=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 C17H16Cl2N4O2S MW 411.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16Cl2N4O2S/c1-10(18)7-8-23-13-14(22(2)16(25)21-15(13)24)20-17(23)26-9-11-5-3-4-6-12(11)19/h3-7H,8-9H2,1-2H3,(H,21,24,25)/b10-7-InChIKey
OBRNDKRFGXUWIC-YFHOEESVSA-NSynonyms
326919-26-0(Z)8((2chlorobenzyl)thio)7(3chlorobut2en1yl)3methyl1Hpurine26(3H7H)dione
326919260
7((2Z)3CHLOROBUT2ENYL)8((2CHLOROPHENYL)METHYLTHIO)3METHYL137TRIHYDROPURINE26DIONE
7((Z)3CHLOROBUT2ENYL)8((2CHLOROPHENYL)METHYLSULFANYL)3METHYLPURINE26DIONE
8((2CHLOROBENZYL)SULFANYL)7((2Z)3CHLOROBUT2EN1YL)3METHYL37DIHYDRO1HPURINE26DIONE
8((2CHLOROBENZYL)SULFANYL)7(3CHLORO2BUTENYL)3METHYL37DIHYDRO1HPURINE26DIONE
CC(=CCn1c(SCc2ccccc2Cl)nc2c1c(=O)(nH)c(=O)n2C)Cl
CC(=CCN1C2=C(N=C1SCC3=CC=CC=C3Cl)N(C(=O)NC2=O)C)Cl
InChI=1SC17H16Cl2N4O2Sc110(18)78231314(22(2)16(25)2115(13)24)2017(23)26911534612(11)19h37H89H212H3(H212425)b107
MFCD01032119
STK022983
ZINC000000662949
ZINC00662949
ZINC662949
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