Vitas-M small molecule compound
3-{[7-(3-fluorophenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]sulfanyl}butan-2-one
Catalog ID
STK890547
SMILES CC(=O)C(Sc1ncnc2c1c(cn2c1cccc(c1)F)c1ccccc1)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 C22H18FN3OS MW 391.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18FN3OS/c1-14(27)15(2)28-22-20-19(16-7-4-3-5-8-16)12-26(21(20)24-13-25-22)18-10-6-9-17(23)11-18/h3-13,15H,1-2H3InChIKey
WHVSTKUUXRCMKP-UHFFFAOYSA-NSynonyms
3((7(3fluorophenyl)5phenyl7Hpyrrolo(23d)pyrimidin4yl)sulfanyl)butan2one
3(7(3FLUOROPHENYL)5PHENYLPYRROLO(23D)PYRIMIDIN4YL)SULFANYLBUTAN2ONE
3(7(3FLUOROPHENYL)5PHENYLPYRROLO(32E)PYRIMIDIN4YLTHIO)BUTAN2ONE
CC(C(=O)C)SC1=NC=NC2=C1C(=CN2C3=CC(=CC=C3)F)C4=CC=CC=C4
InChI=1SC22H18FN3OSc114(27)15(2)28222019(167435816)1226(21(20)24132522)18106917(23)1118h31315H12H3
MFCD04453651
ZINC000003658700
ZINC000003658701
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