Vitas-M small molecule compound
2,5-bis(1H-benzotriazol-1-yl)-3,6-di(piperidin-1-yl)cyclohexa-2,5-diene-1,4-dione
Catalog ID
STK547413
SMILES O=C1C(=C(N2CCCCC2)C(=O)C(=C1N1CCCCC1)n1nnc2c1cccc2)n1nnc2c1cccc2
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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 C28H28N8O2 MW 508.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N8O2/c37-27-23(33-15-7-1-8-16-33)25(35-21-13-5-3-11-19(21)29-31-35)28(38)24(34-17-9-2-10-18-34)26(27)36-22-14-6-4-12-20(22)30-32-36/h3-6,11-14H,1-2,7-10,15-18H2InChIKey
BKOXZVVTVZCRAU-UHFFFAOYSA-NSynonyms
383898-48-425bis(1Hbenzo(d)(123)triazol1yl)36di(piperidin1yl)cyclohexa25diene14dione
25bis(1Hbenzotriazol1yl)36di(piperidin1yl)cyclohexa25diene14dione
25BIS(BENZOTRIAZOL1YL)36DI(PIPERIDIN1YL)CYCLOHEXA25DIENE14DIONE
383898484
C1CCN(CC1)C2=C(C(=O)C(=C(C2=O)N3C4=CC=CC=C4N=N3)N5CCCCC5)N6C7=CC=CC=C7N=N6
InChI=1SC28H28N8O2c372723(33157181633)25(352113531119(21)293135)28(38)24(341792101834)26(27)362214641220(22)303236h361114H127101518H2
MFCD03283746
ZINC000001246455
ZINC1246455
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