Vitas-M small molecule compound
4-hydroxy-2-phenyl-6-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]methyl}-1,2-dihydro-3H-pyrazolo[3,4-b]pyridin-3-one
Catalog ID
STL151366
SMILES Oc1cc(CSc2nnnn2c2ccccc2)nc2c1c(=O)n([nH]2)c1ccccc1
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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 C20H15N7O2S MW 417.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15N7O2S/c28-16-11-13(12-30-20-22-24-25-27(20)15-9-5-2-6-10-15)21-18-17(16)19(29)26(23-18)14-7-3-1-4-8-14/h1-11H,12H2,(H2,21,23,28)InChIKey
AGKYOODUQOEVHZ-UHFFFAOYSA-NSynonyms
838844-88-52PHENYL6(((1PHENYL1HTETRAZOL5YL)THIO)METHYL)1HPYRAZOLO(34B)PYRIDINE34(2H7H)DIONE
2PHENYL6((1PHENYLTETRAZOL5YL)SULFANYLMETHYL)17DIHYDROPYRAZOLO(34B)PYRIDINE34DIONE
4hydroxy2phenyl6(((1phenyl1Htetrazol5yl)sulfanyl)methyl)12dihydro3Hpyrazolo(34b)pyridin3one
838844885
C1=CC=C(C=C1)N2C(=O)C3=C(N2)NC(=CC3=O)CSC4=NN=NN4C5=CC=CC=C5
InChI=1SC20H15N7O2Sc28161113(12302022242527(20)1595261015)211817(16)19(29)26(2318)147314814h111H12H2(H2212328)
MFCD07209344
Oc1cc(CSc2nnnn2c2ccccc2)nc2c1c(=O)n((nH)2)c1ccccc1
ZINC000009014249
ZINC09014249
ZINC9014249
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