Vitas-M small molecule compound
N-(1,3-benzodioxol-5-yl)-2-[(1-benzyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]acetamide
Catalog ID
STL346624
SMILES O=C(Nc1ccc2c(c1)OCO2)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 C21H17N5O3S MW 419.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N5O3S/c27-19(25-15-6-7-17-18(8-15)29-13-28-17)11-30-21-16-9-24-26(20(16)22-12-23-21)10-14-4-2-1-3-5-14/h1-9,12H,10-11,13H2,(H,25,27)InChIKey
YTFVYAFNUVVYJG-UHFFFAOYSA-NSynonyms
848932-73-0848932730
C1OC2=C(O1)C=C(C=C2)NC(=O)CSC3=NC=NC4=C3C=NN4CC5=CC=CC=C5
InChI=1SC21H17N5O3Sc2719(2515671718(815)29132817)1130211692426(20(16)22122321)10144213514h1912H101113H2(H2527)
MFCD04013579
N(13benzodioxol5yl)2((1benzyl1Hpyrazolo(34d)pyrimidin4yl)sulfanyl)acetamide
N(13BENZODIOXOL5YL)2(1BENZYLPYRAZOLO(34D)PYRIMIDIN4YL)SULFANYLACETAMIDE
N(benzo(d)(13)dioxol5yl)2((1benzyl1Hpyrazolo(34d)pyrimidin4yl)thio)acetamide
ZINC000002445804
ZINC02445804
ZINC2445804
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