Vitas-M small molecule compound
2-[(1-benzyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]-1-(3,4-dimethoxyphenyl)ethanone
Catalog ID
STL349258
SMILES COc1cc(ccc1OC)C(=O)CSc1ncnc2c1cnn2Cc1ccccc1
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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 C22H20N4O3S MW 420.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N4O3S/c1-28-19-9-8-16(10-20(19)29-2)18(27)13-30-22-17-11-25-26(21(17)23-14-24-22)12-15-6-4-3-5-7-15/h3-11,14H,12-13H2,1-2H3InChIKey
SEBCHSZDIIYSPJ-UHFFFAOYSA-NSynonyms
877793-33-42((1benzyl1Hpyrazolo(34d)pyrimidin4yl)sulfanyl)1(34dimethoxyphenyl)ethanone
2((1benzyl1Hpyrazolo(34d)pyrimidin4yl)thio)1(34dimethoxyphenyl)ethanone
2(1BENZYLPYRAZOLO(34D)PYRIMIDIN4YL)SULFANYL1(34DIMETHOXYPHENYL)ETHANONE
877793334
COC1=C(C=C(C=C1)C(=O)CSC2=NC=NC3=C2C=NN3CC4=CC=CC=C4)OC
InChI=1SC22H20N4O3Sc128199816(1020(19)292)18(27)13302217112526(21(17)23142422)12156435715h31114H1213H212H3
MFCD05702622
ZINC000009345469
ZINC09345469
ZINC9345469
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