Vitas-M small molecule compound

2-(1,3-benzothiazol-2-yl)-4-methyl-3,6-dioxo-5-(tetrahydrofuran-2-ylmethyl)-2,3,5,6-tetrahydropyrazolo[4,3-c]pyridin-1-ide

Catalog ID
STK207371
SMILES O=c1n([n-]c2c1c(C)n(c(=O)c2)CC1CCCO1)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 C19H17N4O3S MW 381.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N4O3S/c1-11-17-14(9-16(24)22(11)10-12-5-4-8-26-12)21-23(18(17)25)19-20-13-6-2-3-7-15(13)27-19/h2-3,6-7,9,12H,4-5,8,10H2,1H3,(H,21,24)/p-1
InChIKey
VRKBGORHURMANH-UHFFFAOYSA-M
Synonyms

2(13benzothiazol2yl)4methyl36dioxo5(tetrahydrofuran2ylmethyl)2356tetrahydropyrazolo(43c)pyridin1ide
ZINC000669458778
ZINC000669458779

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.