Vitas-M small molecule compound

ethyl 4-[3-(phenylsulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-yl]piperazine-1-carboxylate

Catalog ID
STL107418
SMILES CCOC(=O)N1CCN(CC1)c1nc2n(c3c1cccc3)nnc2S(=O)(=O)c1ccccc1

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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 C22H22N6O4S MW 466.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N6O4S/c1-2-32-22(29)27-14-12-26(13-15-27)19-17-10-6-7-11-18(17)28-20(23-19)21(24-25-28)33(30,31)16-8-4-3-5-9-16/h3-11H,2,12-15H2,1H3
InChIKey
ABSXBOYUCGXCJP-UHFFFAOYSA-N
Synonyms

CCOC(=O)N1CCN(CC1)C2=NC3=C(N=NN3C4=CC=CC=C42)S(=O)(=O)C5=CC=CC=C5
ethyl4(3(benzenesulfonyl)triazolo(15a)quinazolin5yl)piperazine1carboxylate
ethyl4(3(phenylsulfonyl)(123)triazolo(15a)quinazolin5yl)piperazine1carboxylate
InChI=1SC22H22N6O4Sc123222(29)27141226(131527)191710671118(17)2820(2319)21(242528)33(3031)168435916h311H21215H21H3
MFCD20740097
ZINC000067262636
ZINC67262636

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Available files

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