Vitas-M small molecule compound
4-{(2Z)-2-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-N-phenyl-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-amine
Catalog ID
STK752766
SMILES [O-][N+](=O)c1cc2OCOc2cc1/C=N\Nc1nc(Nc2ccccc2)nc(n1)N1CCCC1
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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 C21H20N8O4 MW 448.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N8O4/c30-29(31)16-11-18-17(32-13-33-18)10-14(16)12-22-27-20-24-19(23-15-6-2-1-3-7-15)25-21(26-20)28-8-4-5-9-28/h1-3,6-7,10-12H,4-5,8-9,13H2,(H2,23,24,25,26,27)/b22-12-InChIKey
TXUYCLSGPCFZGT-UUYOSTAYSA-NSynonyms
(O)(N+)(=O)c1cc2OCOc2cc1C=NNc1nc(Nc2ccccc2)nc(n1)N1CCCC1
2N((Z)(6NITRO13BENZODIOXOL5YL)METHYLIDENEAMINO)4NPHENYL6PYRROLIDIN1YL135TRIAZINE24DIAMINE
4((2Z)2((6NITRO13BENZODIOXOL5YL)METHYLIDENE)HYDRAZINYL)NPHENYL6(PYRROLIDIN1YL)135TRIAZIN2AMINE
C1CCN(C1)C2=NC(=NC(=N2)NN=CC3=CC4=C(C=C3(N+)(=O)(O))OCO4)NC5=CC=CC=C5
InChI=1SC21H20N8O4c3029(31)16111817(32133318)1014(16)122227202419(23156213715)2521(2620)28845928h13671012H458913H2(H22324252627)b2212
MFCD00821514
ZINC000032929299
ZINC35227412
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