Vitas-M small molecule compound
2-[(1-benzyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]-N-(3-chloro-4-fluorophenyl)acetamide
Catalog ID
STL347359
SMILES O=C(Nc1ccc(c(c1)Cl)F)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 C20H15ClFN5OS MW 427.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15ClFN5OS/c21-16-8-14(6-7-17(16)22)26-18(28)11-29-20-15-9-25-27(19(15)23-12-24-20)10-13-4-2-1-3-5-13/h1-9,12H,10-11H2,(H,26,28)InChIKey
MCTQVXGQMRKITL-UHFFFAOYSA-NSynonyms
585561-90-62((1benzyl1Hpyrazolo(34d)pyrimidin4yl)sulfanyl)N(3chloro4fluorophenyl)acetamide
2((1benzyl1Hpyrazolo(34d)pyrimidin4yl)thio)N(3chloro4fluorophenyl)acetamide
2(1BENZYLPYRAZOLO(34D)PYRIMIDIN4YL)SULFANYLN(3CHLORO4FLUOROPHENYL)ACETAMIDE
585561906
C1=CC=C(C=C1)CN2C3=C(C=N2)C(=NC=N3)SCC(=O)NC4=CC(=C(C=C4)F)Cl
InChI=1SC20H15ClFN5OSc2116814(6717(16)22)2618(28)1129201592527(19(15)23122420)10134213513h1912H1011H2(H2628)
MFCD04030385
ZINC000009307072
ZINC09307072
ZINC9307072
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