Vitas-M small molecule compound

4-benzyl-5-(3,6-dicyclopropyl-1-methyl-1H-pyrazolo[3,4-b]pyridin-4-yl)-4H-1,2,4-triazole-3-thiol

Catalog ID
STL399680
SMILES Cn1nc(c2c1nc(cc2c1nnc(n1Cc1ccccc1)S)C1CC1)C1CC1

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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 C22H22N6S MW 402.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N6S/c1-27-21-18(19(26-27)15-9-10-15)16(11-17(23-21)14-7-8-14)20-24-25-22(29)28(20)12-13-5-3-2-4-6-13/h2-6,11,14-15H,7-10,12H2,1H3,(H,25,29)
InChIKey
BCXNMCSNUGKTNK-UHFFFAOYSA-N
Synonyms
866765-04-0
4benzyl3(36dicyclopropyl1methylpyrazolo(34b)pyridin4yl)1H124triazole5thione
4BENZYL5(36DICYCLOPROPYL1METHYL1HPYRAZOLO(34B)PYRIDIN4YL)4H124TRIAZOLE3THIOL
866765040
CN1C2=C(C(=CC(=N2)C3CC3)C4=NNC(=S)N4CC5=CC=CC=C5)C(=N1)C6CC6
InChI=1SC22H22N6Sc1272118(19(2627)1591015)16(1117(2321)147814)20242522(29)28(20)12135324613h26111415H71012H21H3(H2529)
MFCD06196387
ZINC000017082522
ZINC17082522

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Available files

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