Vitas-M small molecule compound
sodium 2-(1,3-benzothiazol-2-yl)-5-(2-methoxybenzyl)-4-methyl-3,6-dioxo-2,3,5,6-tetrahydropyrazolo[4,3-c]pyridin-1-ide
Catalog ID
STK328615
SMILES COc1ccccc1Cn1c(=O)cc2c(c1C)c(=O)n([n-]2)c1nc2c(s1)cccc2.[Na+]
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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 C22H17N4NaO3S MW 440.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N4O3S.Na/c1-13-20-16(11-19(27)25(13)12-14-7-3-5-9-17(14)29-2)24-26(21(20)28)22-23-15-8-4-6-10-18(15)30-22;/h3-11H,12H2,1-2H3,(H,24,27);/q;+1/p-1InChIKey
GQPLVGDLXCODHU-UHFFFAOYSA-MSynonyms
2BENZOTHIAZOL2YL5((2METHOXYPHENYL)METHYL)4METHYL5HYDRO3PYRAZOLINO(43C)PYRIDINE36DIONESODIUMSALT
CC1=C2C(=CC(=O)N1CC3=CC=CC=C3OC)(N)N(C2=O)C4=NC5=CC=CC=C5S4(Na+)
COc1ccccc1Cn1c(=O)cc2c(c1C)c(=O)n((n)2)c1nc2c(s1)cccc2(Na+)
InChI=1SC22H18N4O3SNac1132016(1119(27)25(13)1214735917(14)292)2426(21(20)28)2223158461018(15)3022h311H12H212H3(H2427)q+1p1
MFCD06242285
SODIUM2(13BENZOTHIAZOL2YL)5((2METHOXYPHENYL)METHYL)4METHYLPYRAZOLO(43C)PYRIDIN1IDE36DIONE
sodium2(13benzothiazol2yl)5(2methoxybenzyl)4methyl36dioxo2356tetrahydropyrazolo(43c)pyridin1ide
SODIUM2(13BENZOTHIAZOL2YL)5(2METHOXYBENZYL)4METHYL3OXO35DIHYDRO2HPYRAZOLO(43C)PYRIDIN6OLATE
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