Vitas-M small molecule compound

N-(5-chloro-2,4-dimethoxyphenyl)-1-(3-methyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)piperidine-4-carboxamide

Catalog ID
STK647461
SMILES COc1cc(OC)c(cc1NC(=O)C1CCN(CC1)c1ccc2n(n1)c(C)nn2)Cl

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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 C20H23ClN6O3 MW 430.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23ClN6O3/c1-12-23-24-18-4-5-19(25-27(12)18)26-8-6-13(7-9-26)20(28)22-15-10-14(21)16(29-2)11-17(15)30-3/h4-5,10-11,13H,6-9H2,1-3H3,(H,22,28)
InChIKey
GYJXQKNCFDBFNU-UHFFFAOYSA-N
Synonyms
1081141-10-7
1081141107
CC1=NN=C2N1N=C(C=C2)N3CCC(CC3)C(=O)NC4=CC(=C(C=C4OC)OC)Cl
InChI=1SC20H23ClN6O3c1122324184519(2527(12)18)268613(7926)20(28)22151014(21)16(292)1117(15)303h45101113H69H213H3(H2228)
MFCD12207601
N(5chloro24dimethoxyphenyl)1(3methyl(124)triazolo(43b)pyridazin6yl)piperidine4carboxamide
ZINC000020728668
ZINC20728668

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Available files

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