Vitas-M small molecule compound
7-(2-fluorobenzyl)-1,3-dimethyl-8-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK743665
SMILES O=C(N1CCOCC1)CSc1nc2c(n1Cc1ccccc1F)c(=O)n(c(=O)n2C)C
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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 C20H22FN5O4S MW 447.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22FN5O4S/c1-23-17-16(18(28)24(2)20(23)29)26(11-13-5-3-4-6-14(13)21)19(22-17)31-12-15(27)25-7-9-30-10-8-25/h3-6H,7-12H2,1-2H3InChIKey
JOVOMBZAQWPZRW-UHFFFAOYSA-NSynonyms
7((2FLUOROPHENYL)METHYL)13DIMETHYL8(2MORPHOLIN4YL2OXOETHYL)SULFANYLPURINE26DIONE
7(2fluorobenzyl)13dimethyl8((2(morpholin4yl)2oxoethyl)sulfanyl)37dihydro1Hpurine26dione
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)SCC(=O)N3CCOCC3)CC4=CC=CC=C4F
InChI=1SC20H22FN5O4Sc1231716(18(28)24(2)20(23)29)26(1113534614(13)21)19(2217)311215(27)25793010825h36H712H212H3
MFCD05259579
ZINC000001423933
ZINC01423933
ZINC1423933
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