Vitas-M small molecule compound
8,10-dinitrobenzo[b][1,2,3]triazolo[4,5,1-jk][1,5]benzodiazepin-7(6H)-one
Catalog ID
STK784253
SMILES O=c1[nH]c2cccc3c2n(c2c1c(cc(c2)[N+](=O)[O-])[N+](=O)[O-])nn3
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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 C13H6N6O5 MW 326.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H6N6O5/c20-13-11-9(4-6(18(21)22)5-10(11)19(23)24)17-12-7(14-13)2-1-3-8(12)15-16-17/h1-5H,(H,14,20)InChIKey
WBZQLAHXNMGNGC-UHFFFAOYSA-NSynonyms
810dinitrobenzo(b)(123)triazolo(451jk)(15)benzodiazepin7(6H)one
C1=CC2=C3C(=C1)NC(=O)C4=C(C=C(C=C4N3N=N2)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC13H6N6O5c2013119(46(18(21)22)510(11)19(23)24)17127(1413)2138(12)151617h15H(H1420)
MFCD07021768
O=c1(nH)c2cccc3c2n(c2c1c(cc(c2)(N+)(=O)(O))(N+)(=O)(O))nn3
ZINC000012375238
ZINC12375238
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