Vitas-M small molecule compound
6-{(2E)-2-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-N-(4-nitrophenyl)-N'-phenyl-1,3,5-triazine-2,4-diamine
Catalog ID
STL407052
SMILES [O-][N+](=O)c1cc2OCOc2cc1/C=N/Nc1nc(Nc2ccc(cc2)[N+](=O)[O-])nc(n1)Nc1ccccc1
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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 C23H17N9O6 MW 515.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17N9O6/c33-31(34)17-8-6-16(7-9-17)26-22-27-21(25-15-4-2-1-3-5-15)28-23(29-22)30-24-12-14-10-19-20(38-13-37-19)11-18(14)32(35)36/h1-12H,13H2,(H3,25,26,27,28,29,30)/b24-12+InChIKey
OWYVVCOHTAGOGW-WYMPLXKRSA-NSynonyms
(O)(N+)(=O)c1cc2OCOc2cc1C=NNc1nc(Nc2ccc(cc2)(N+)(=O)(O))nc(n1)Nc1ccccc1
2N((E)(6nitro13benzodioxol5yl)methylideneamino)4N(4nitrophenyl)6Nphenyl135triazine246triamine
6((2E)2((6nitro13benzodioxol5yl)methylidene)hydrazinyl)N(4nitrophenyl)Nphenyl135triazine24diamine
C1OC2=C(O1)C=C(C(=C2)C=NNC3=NC(=NC(=N3)NC4=CC=C(C=C4)(N+)(=O)(O))NC5=CC=CC=C5)(N+)(=O)(O)
InChI=1SC23H17N9O6c3331(34)178616(7917)26222721(25154213515)2823(2922)30241214101920(38133719)1118(14)32(35)36h112H13H2(H3252627282930)b2412+
MFCD04084067
ZINC000016490557
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