Vitas-M small molecule compound
1-(2-chloroethyl)-1H-naphtho[2,3-d][1,2,3]triazole-4,9-dione 2-oxide
Catalog ID
STK775886
SMILES ClCCn1[n+]([O-])nc2c1C(=O)c1ccccc1C2=O
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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 C12H8ClN3O3 MW 277.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H8ClN3O3/c13-5-6-15-10-9(14-16(15)19)11(17)7-3-1-2-4-8(7)12(10)18/h1-4H,5-6H2InChIKey
BTRCDAIHWNOHJG-UHFFFAOYSA-NSynonyms
1(2chloroethyl)1Hnaphtho(23d)(123)triazole49dione2oxide
1(2CHLOROETHYL)2HYDROXYHYDROBENZO(F)BENZOTRIAZOLE49DIONE
3(2CHLOROETHYL)2OXIDOBENZO(F)BENZOTRIAZOL2IUM49DIONE
C1=CC=C2C(=C1)C(=O)C3=C(C2=O)N((N+)(=N3)(O))CCCl
ClCCn1(n+)((O))nc2c1C(=O)c1ccccc1C2=O
InChI=1SC12H8ClN3O3c135615109(1416(15)19)11(17)731248(7)12(10)18h14H56H2
MFCD05257981
ZINC000334157411
ZINC01422563
ZINC1422563
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