Vitas-M small molecule compound
N-(3,4-dimethylphenyl)-6-[(2E)-2-(2-methoxy-5-nitrobenzylidene)hydrazinyl]-N'-(4-nitrophenyl)-1,3,5-triazine-2,4-diamine
Catalog ID
STK670286
SMILES COc1ccc(cc1/C=N/Nc1nc(Nc2ccc(cc2)[N+](=O)[O-])nc(n1)Nc1ccc(c(c1)C)C)[N+](=O)[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 C25H23N9O5 MW 529.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N9O5/c1-15-4-5-19(12-16(15)2)28-24-29-23(27-18-6-8-20(9-7-18)33(35)36)30-25(31-24)32-26-14-17-13-21(34(37)38)10-11-22(17)39-3/h4-14H,1-3H3,(H3,27,28,29,30,31,32)/b26-14+InChIKey
RPRWREKZMGWNQO-VULFUBBASA-NSynonyms
4N(34dimethylphenyl)2N((E)(2methoxy5nitrophenyl)methylideneamino)6N(4nitrophenyl)135triazine246triamine
CC1=C(C=C(C=C1)NC2=NC(=NC(=N2)NC3=CC=C(C=C3)(N+)(=O)(O))NN=CC4=C(C=CC(=C4)(N+)(=O)(O))OC)C
COc1ccc(cc1C=NNc1nc(Nc2ccc(cc2)(N+)(=O)(O))nc(n1)Nc1ccc(c(c1)C)C)(N+)(=O)(O)
InChI=1SC25H23N9O5c1154519(1216(15)2)28242923(27186820(9718)33(35)36)3025(3124)322614171321(34(37)38)101122(17)393h414H13H3(H3272829303132)b2614+
MFCD00313895
N(34DIMETHYLPHENYL)6((2E)2(2METHOXY5NITROBENZYLIDENE)HYDRAZINYL)N(4NITROPHENYL)135TRIAZINE24DIAMINE
ZINC000100036658
ZINC102774535
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