Vitas-M small molecule compound
8-[(4-fluorobenzyl)sulfanyl]-3-methyl-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK839796
SMILES C=CCn1c(SCc2ccc(cc2)F)nc2c1c(=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 C16H15FN4O2S MW 346.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15FN4O2S/c1-3-8-21-12-13(20(2)15(23)19-14(12)22)18-16(21)24-9-10-4-6-11(17)7-5-10/h3-7H,1,8-9H2,2H3,(H,19,22,23)InChIKey
POAYRZMVXBIWRP-UHFFFAOYSA-NSynonyms
378200-42-1378200421
7ALLYL8((4FLUOROBENZYL)THIO)3METHYL1HPURINE26(3H7H)DIONE
7ALLYL8((4FLUOROBENZYL)THIO)3METHYLXANTHINE
8((4fluorobenzyl)sulfanyl)3methyl7(prop2en1yl)37dihydro1Hpurine26dione
8((4FLUOROPHENYL)METHYLSULFANYL)3METHYL7PROP2ENYLPURINE26DIONE
8((4FLUOROPHENYL)METHYLTHIO)3METHYL7PROP2ENYL137TRIHYDROPURINE26DIONE
8((4FLUOROPHENYL)METHYLTHIO)3METHYL7PROP2ENYLPURINE26DIONE
C=CCn1c(SCc2ccc(cc2)F)nc2c1c(=O)(nH)c(=O)n2C
CN1C2=C(C(=O)NC1=O)N(C(=N2)SCC3=CC=C(C=C3)F)CC=C
InChI=1SC16H15FN4O2Sc138211213(20(2)15(23)1914(12)22)1816(21)249104611(17)7510h37H189H22H3(H192223)
MFCD02984135
ZINC000000079509
ZINC00079509
ZINC79509
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