Vitas-M small molecule compound
6-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-3-methyl[1,2,4]triazolo[3,4-a]phthalazine
Catalog ID
STK796529
SMILES Cc1ccc(cc1S(=O)(=O)N1CCCCCC1)c1nn2c(C)nnc2c2c1cccc2
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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 C23H25N5O2S MW 435.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N5O2S/c1-16-11-12-18(15-21(16)31(29,30)27-13-7-3-4-8-14-27)22-19-9-5-6-10-20(19)23-25-24-17(2)28(23)26-22/h5-6,9-12,15H,3-4,7-8,13-14H2,1-2H3InChIKey
PLCXTSXIDWOWQR-UHFFFAOYSA-NSynonyms
900879-85-86(3(azepan1ylsulfonyl)4methylphenyl)3methyl(124)triazolo(34a)phthalazine
900879858
CC1=C(C=C(C=C1)C2=NN3C(=NN=C3C4=CC=CC=C42)C)S(=O)(=O)N5CCCCCC5
InChI=1SC23H25N5O2Sc116111218(1521(16)31(2930)271373481427)22199561020(19)23252417(2)28(23)2622h5691215H34781314H212H3
MFCD06774852
ZINC000009451146
ZINC09451146
ZINC9451146
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