Vitas-M small molecule compound
4-{[7-(2-fluorobenzyl)-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]sulfanyl}butanenitrile
Catalog ID
STK720224
SMILES N#CCCCSc1nc2c(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 C18H18FN5O2S MW 387.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18FN5O2S/c1-22-15-14(16(25)23(2)18(22)26)24(11-12-7-3-4-8-13(12)19)17(21-15)27-10-6-5-9-20/h3-4,7-8H,5-6,10-11H2,1-2H3InChIKey
GSDIPVFJRICBLL-UHFFFAOYSA-NSynonyms
4((7((2FLUOROPHENYL)METHYL)13DIMETHYL26DIOXO8PURINYL)THIO)BUTANENITRILE
4((7(2fluorobenzyl)13dimethyl26dioxo2367tetrahydro1Hpurin8yl)sulfanyl)butanenitrile
4((7(2FLUOROBENZYL)26DIKETO13DIMETHYLPURIN8YL)THIO)BUTYRONITRILE
4(7((2FLUOROPHENYL)METHYL)13DIMETHYL26BIS(OXIDANYLIDENE)PURIN8YL)SULFANYLBUTANENITRILE
4(7((2FLUOROPHENYL)METHYL)13DIMETHYL26DIOXOPURIN8YL)SULFANYLBUTANENITRILE
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)SCCCC#N)CC3=CC=CC=C3F
InChI=1SC18H18FN5O2Sc1221514(16(25)23(2)18(22)26)24(1112734813(12)19)17(2115)271065920h3478H561011H212H3
MFCD03698046
ZINC000012427897
ZINC12427897
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