Vitas-M small molecule compound
methyl 2-{[7-(4-fluorophenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]sulfanyl}butanoate
Catalog ID
STK890619
SMILES CCC(C(=O)OC)Sc1ncnc2c1c(cn2c1ccc(cc1)F)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 C23H20FN3O2S MW 421.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20FN3O2S/c1-3-19(23(28)29-2)30-22-20-18(15-7-5-4-6-8-15)13-27(21(20)25-14-26-22)17-11-9-16(24)10-12-17/h4-14,19H,3H2,1-2H3InChIKey
HIGUHTLHBBEDLO-UHFFFAOYSA-NSynonyms
CCC(C(=O)OC)SC1=NC=NC2=C1C(=CN2C3=CC=C(C=C3)F)C4=CC=CC=C4
InChI=1SC23H20FN3O2Sc1319(23(28)292)30222018(157546815)1327(21(20)25142622)1711916(24)101217h41419H3H212H3
methyl2((7(4fluorophenyl)5phenyl7Hpyrrolo(23d)pyrimidin4yl)sulfanyl)butanoate
METHYL2(7(4FLUOROPHENYL)5PHENYLPYRROLO(23D)PYRIMIDIN4YL)SULFANYLBUTANOATE
METHYL2(7(4FLUOROPHENYL)5PHENYLPYRROLO(32E)PYRIMIDIN4YLTHIO)BUTANOATE
MFCD04453624
ZINC000003658666
ZINC000003658667
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