Vitas-M small molecule compound
5-(1,3-benzodioxol-5-ylmethyl)-2-(1,3-benzothiazol-2-yl)-1-benzyl-4-methyl-1H-pyrazolo[4,3-c]pyridine-3,6(2H,5H)-dione
Catalog ID
STK207239
SMILES O=c1cc2c(c(n1Cc1ccc3c(c1)OCO3)C)c(=O)n(n2Cc1ccccc1)c1nc2c(s1)cccc2
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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 C29H22N4O4S MW 522.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H22N4O4S/c1-18-27-22(14-26(34)31(18)15-20-11-12-23-24(13-20)37-17-36-23)32(16-19-7-3-2-4-8-19)33(28(27)35)29-30-21-9-5-6-10-25(21)38-29/h2-14H,15-17H2,1H3InChIKey
JKJLNSLZSRJFEO-UHFFFAOYSA-NSynonyms
5(13benzodioxol5ylmethyl)2(13benzothiazol2yl)1benzyl4methyl1Hpyrazolo(43c)pyridine36(2H5H)dione
5(13benzodioxol5ylmethyl)2(13benzothiazol2yl)1benzyl4methylpyrazolo(43c)pyridine36dione
5(2HBENZO(34D)13DIOXOLAN5YLMETHYL)2BENZOTHIAZOL2YL4METHYL1BENZYL5HYDRO3PYRAZOLINO(43C)PYRIDINE36DIONE
CC1=C2C(=CC(=O)N1CC3=CC4=C(C=C3)OCO4)N(N(C2=O)C5=NC6=CC=CC=C6S5)CC7=CC=CC=C7
InChI=1SC29H22N4O4Sc1182722(1426(34)31(18)152011122324(1320)37173623)32(16197324819)33(28(27)35)2930219561025(21)3829h214H1517H21H3
MFCD06754427
ZINC000097945323
ZINC97945323
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