Vitas-M small molecule compound

2-(1,3-benzothiazol-2-yl)-4-methyl-1-(pyridin-2-ylmethyl)-5-(tetrahydrofuran-2-ylmethyl)-1H-pyrazolo[4,3-c]pyridine-3,6(2H,5H)-dione

Catalog ID
STK337117
SMILES O=c1n(c2nc3c(s2)cccc3)n(c2c1c(C)n(CC1CCCO1)c(=O)c2)Cc1ccccn1

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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 C25H23N5O3S MW 473.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N5O3S/c1-16-23-20(13-22(31)28(16)15-18-8-6-12-33-18)29(14-17-7-4-5-11-26-17)30(24(23)32)25-27-19-9-2-3-10-21(19)34-25/h2-5,7,9-11,13,18H,6,8,12,14-15H2,1H3
InChIKey
SDCAMLQHQRVVAN-UHFFFAOYSA-N
Synonyms

2(13benzothiazol2yl)4methyl1(pyridin2ylmethyl)5(tetrahydrofuran2ylmethyl)1Hpyrazolo(43c)pyridine36(2H5H)dione
2(13benzothiazol2yl)4methyl5(oxolan2ylmethyl)1(pyridin2ylmethyl)pyrazolo(43c)pyridine36dione
CC1=C2C(=CC(=O)N1CC3CCCO3)N(N(C2=O)C4=NC5=CC=CC=C5S4)CC6=CC=CC=N6
InChI=1SC25H23N5O3Sc1162320(1322(31)28(16)151886123318)29(1417745112617)30(24(23)32)2527199231021(19)3425h2579111318H68121415H21H3
MFCD09964694
ZINC000012843301
ZINC000012843303

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Available files

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