Vitas-M small molecule compound

4-[(2E)-2-(2-chloro-5-nitrobenzylidene)hydrazinyl]-N-phenyl-6-(piperidin-1-yl)-1,3,5-triazin-2-amine

Catalog ID
STK755398
SMILES Clc1ccc(cc1/C=N/Nc1nc(Nc2ccccc2)nc(n1)N1CCCCC1)[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 C21H21ClN8O2 MW 452.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21ClN8O2/c22-18-10-9-17(30(31)32)13-15(18)14-23-28-20-25-19(24-16-7-3-1-4-8-16)26-21(27-20)29-11-5-2-6-12-29/h1,3-4,7-10,13-14H,2,5-6,11-12H2,(H2,24,25,26,27,28)/b23-14+
InChIKey
KFDVFGFDTZYPKY-OEAKJJBVSA-N
Synonyms

2N((E)(2CHLORO5NITROPHENYL)METHYLIDENEAMINO)4NPHENYL6PIPERIDIN1YL135TRIAZINE24DIAMINE
4((2E)2(2chloro5nitrobenzylidene)hydrazinyl)Nphenyl6(piperidin1yl)135triazin2amine
C1CCN(CC1)C2=NC(=NC(=N2)NN=CC3=C(C=CC(=C3)(N+)(=O)(O))Cl)NC4=CC=CC=C4
Clc1ccc(cc1C=NNc1nc(Nc2ccccc2)nc(n1)N1CCCCC1)(N+)(=O)(O)
InChI=1SC21H21ClN8O2c221810917(30(31)32)1315(18)142328202519(24167314816)2621(2720)29115261229h1347101314H2561112H2(H22425262728)b2314+
MFCD00763690
ZINC000006473851
ZINC33921342

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Available files

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