Vitas-M small molecule compound
5-{[7-(2-fluorobenzyl)-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]sulfanyl}pentanenitrile
Catalog ID
STK743956
SMILES N#CCCCCSc1nc2c(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 C19H20FN5O2S MW 401.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20FN5O2S/c1-23-16-15(17(26)24(2)19(23)27)25(12-13-8-4-5-9-14(13)20)18(22-16)28-11-7-3-6-10-21/h4-5,8-9H,3,6-7,11-12H2,1-2H3InChIKey
WVDCLQQIFYDJDR-UHFFFAOYSA-NSynonyms
728036-93-95((7(2fluorobenzyl)13dimethyl26dioxo2367tetrahydro1Hpurin8yl)sulfanyl)pentanenitrile
5((7(2fluorobenzyl)13dimethyl26dioxo2367tetrahydro1Hpurin8yl)thio)pentanenitrile
5(7((2FLUOROPHENYL)METHYL)13DIMETHYL26DIOXOPURIN8YL)SULFANYLPENTANENITRILE
728036939
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)SCCCCC#N)CC3=CC=CC=C3F
InChI=1SC19H20FN5O2Sc1231615(17(26)24(2)19(23)27)25(1213845914(13)20)18(2216)28117361021h4589H3671112H212H3
MFCD06017354
ZINC000004386102
ZINC04386102
ZINC4386102
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