Vitas-M small molecule compound
2-{[1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl}-N-(2-ethylphenyl)acetamide
Catalog ID
STL347694
SMILES CCc1ccccc1NC(=O)CSc1ncnc2c1cnn2c1ccc(cc1)Cl
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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 C21H18ClN5OS MW 423.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClN5OS/c1-2-14-5-3-4-6-18(14)26-19(28)12-29-21-17-11-25-27(20(17)23-13-24-21)16-9-7-15(22)8-10-16/h3-11,13H,2,12H2,1H3,(H,26,28)InChIKey
XIDKDYZCAJEFTR-UHFFFAOYSA-NSynonyms
573696-02-32((1(4chlorophenyl)1Hpyrazolo(34d)pyrimidin4yl)sulfanyl)N(2ethylphenyl)acetamide
2((1(4chlorophenyl)1Hpyrazolo(34d)pyrimidin4yl)thio)N(2ethylphenyl)acetamide
2(1(4CHLOROPHENYL)PYRAZOLO(34D)PYRIMIDIN4YL)SULFANYLN(2ETHYLPHENYL)ACETAMIDE
573696023
CCC1=CC=CC=C1NC(=O)CSC2=NC=NC3=C2C=NN3C4=CC=C(C=C4)Cl
InChI=1SC21H18ClN5OSc1214534618(14)2619(28)12292117112527(20(17)23132421)169715(22)81016h31113H212H21H3(H2628)
MFCD04017706
ZINC000009307937
ZINC09307937
ZINC9307937
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