Vitas-M small molecule compound
methyl 2-{[7-(4-methoxyphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]sulfanyl}propanoate
Catalog ID
STK890565
SMILES COC(=O)C(Sc1ncnc2c1c(cn2c1ccc(cc1)OC)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 C23H21N3O3S MW 419.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O3S/c1-15(23(27)29-3)30-22-20-19(16-7-5-4-6-8-16)13-26(21(20)24-14-25-22)17-9-11-18(28-2)12-10-17/h4-15H,1-3H3InChIKey
SSQYQQITSVGRBC-UHFFFAOYSA-NSynonyms
CC(C(=O)OC)SC1=NC=NC2=C1C(=CN2C3=CC=C(C=C3)OC)C4=CC=CC=C4
InChI=1SC23H21N3O3Sc115(23(27)293)30222019(167546816)1326(21(20)24142522)1791118(282)121017h415H13H3
methyl2((7(4methoxyphenyl)5phenyl7Hpyrrolo(23d)pyrimidin4yl)sulfanyl)propanoate
METHYL2(7(4METHOXYPHENYL)5PHENYLPYRROLO(23D)PYRIMIDIN4YL)SULFANYLPROPANOATE
METHYL2(7(4METHOXYPHENYL)5PHENYLPYRROLO(32E)PYRIMIDIN4YLTHIO)PROPANOATE
MFCD04453696
ZINC000003658754
ZINC000003658755
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