Vitas-M small molecule compound
3-{[7-(4-methoxyphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]sulfanyl}butan-2-one
Catalog ID
STK890540
SMILES COc1ccc(cc1)n1cc(c2c1ncnc2SC(C(=O)C)C)c1ccccc1
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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 C23H21N3O2S MW 403.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O2S/c1-15(27)16(2)29-23-21-20(17-7-5-4-6-8-17)13-26(22(21)24-14-25-23)18-9-11-19(28-3)12-10-18/h4-14,16H,1-3H3InChIKey
ITYYBSFFDDQBQJ-UHFFFAOYSA-NSynonyms
3((7(4methoxyphenyl)5phenyl7Hpyrrolo(23d)pyrimidin4yl)sulfanyl)butan2one
3(7(4METHOXYPHENYL)5PHENYLPYRROLO(23D)PYRIMIDIN4YL)SULFANYLBUTAN2ONE
3(7(4METHOXYPHENYL)5PHENYLPYRROLO(32E)PYRIMIDIN4YLTHIO)BUTAN2ONE
CC(C(=O)C)SC1=NC=NC2=C1C(=CN2C3=CC=C(C=C3)OC)C4=CC=CC=C4
InChI=1SC23H21N3O2Sc115(27)16(2)29232120(177546817)1326(22(21)24142523)1891119(283)121018h41416H13H3
MFCD04453698
ZINC000003658758
ZINC000003658759
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