Vitas-M small molecule compound
7-(4-fluorobenzyl)-1,3-dimethyl-8-[(1-methyl-1H-imidazol-2-yl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK386312
SMILES Fc1ccc(cc1)Cn1c(nc2c1c(=O)n(C)c(=O)n2C)Sc1nccn1C
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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 C18H17FN6O2S MW 400.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17FN6O2S/c1-22-9-8-20-16(22)28-17-21-14-13(15(26)24(3)18(27)23(14)2)25(17)10-11-4-6-12(19)7-5-11/h4-9H,10H2,1-3H3InChIKey
ZYJDDNZAUPQLPK-UHFFFAOYSA-NSynonyms
7((4FLUOROPHENYL)METHYL)13DIMETHYL8(1METHYLIMIDAZOL2YL)SULFANYLPURINE26DIONE
7((4FLUOROPHENYL)METHYL)13DIMETHYL8(1METHYLIMIDAZOL2YLTHIO)137TRIHYDROPURINE26DIONE
7(4FLUOROBENZYL)13DIMETHYL8((1METHYL1HIMIDAZOL2YL)SULFANYL)37DIHYDRO1HPURINE26DIONE
CN1C=CN=C1SC2=NC3=C(N2CC4=CC=C(C=C4)F)C(=O)N(C(=O)N3C)C
InChI=1SC18H17FN6O2Sc122982016(22)2817211413(15(26)24(3)18(27)23(14)2)25(17)10114612(19)7511h49H10H213H3
MFCD02623488
ZINC000004113110
ZINC04113110
ZINC4113110
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