Vitas-M small molecule compound
7-(4-chlorobenzyl)-3-methyl-8-(prop-2-en-1-ylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK051829
SMILES C=CCSc1nc2c(n1Cc1ccc(cc1)Cl)c(=O)[nH]c(=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 C16H15ClN4O2S MW 362.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15ClN4O2S/c1-3-8-24-16-18-13-12(14(22)19-15(23)20(13)2)21(16)9-10-4-6-11(17)7-5-10/h3-7H,1,8-9H2,2H3,(H,19,22,23)InChIKey
UVOIHYZRARHSQY-UHFFFAOYSA-NSynonyms
313479-83-3313479833
7((4CHLOROPHENYL)METHYL)3METHYL8PROP2ENYLSULFANYLPURINE26DIONE
7(4CHLOROBENZYL)3METHYL8(PROP2EN1YLSULFANYL)37DIHYDRO1HPURINE26DIONE
8(ALLYLTHIO)7(4CHLOROBENZYL)3METHYL1HPURINE26(3H7H)DIONE
8ALLYLSULFANYL7(4CHLOROBENZYL)3METHYL37DIHYDROPURINE26DIONE
C=CCSc1nc2c(n1Cc1ccc(cc1)Cl)c(=O)(nH)c(=O)n2C
CN1C2=C(C(=O)NC1=O)N(C(=N2)SCC=C)CC3=CC=C(C=C3)Cl
InChI=1SC16H15ClN4O2Sc1382416181312(14(22)1915(23)20(13)2)21(16)9104611(17)7510h37H189H22H3(H192223)
MFCD01051139
STK051829
ZINC000002250744
ZINC02250744
ZINC2250744
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