Vitas-M small molecule compound

2-(4-benzylpiperazin-1-yl)-4-[(2E)-2-(4-nitrobenzylidene)hydrazinyl]-6-(3,3,3-trifluoropropoxy)-1,3,5-triazine

Catalog ID
STK015909
SMILES [O-][N+](=O)c1ccc(cc1)/C=N/Nc1nc(OCCC(F)(F)F)nc(n1)N1CCN(CC1)Cc1ccccc1

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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 C24H25F3N8O3 MW 530.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25F3N8O3/c25-24(26,27)10-15-38-23-30-21(32-28-16-18-6-8-20(9-7-18)35(36)37)29-22(31-23)34-13-11-33(12-14-34)17-19-4-2-1-3-5-19/h1-9,16H,10-15,17H2,(H,29,30,31,32)/b28-16+
InChIKey
GPHDIIUBYXADKS-LQKURTRISA-N
Synonyms

(O)(N+)(=O)c1ccc(cc1)C=NNc1nc(OCCC(F)(F)F)nc(n1)N1CCN(CC1)Cc1ccccc1
2(4BENZYLPIPERAZIN1YL)4((2E)2(4NITROBENZYLIDENE)HYDRAZINYL)6(333TRIFLUOROPROPOXY)135TRIAZINE
4(4benzylpiperazin1yl)N((E)(4nitrophenyl)methylideneamino)6(333trifluoropropoxy)135triazin2amine
C1CN(CCN1CC2=CC=CC=C2)C3=NC(=NC(=N3)OCCC(F)(F)F)NN=CC4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC24H25F3N8O3c2524(2627)101538233021(322816186820(9718)35(36)37)2922(3123)34131133(121434)17194213519h1916H101517H2(H29303132)b2816+
MFCD01903306
STK015909
ZINC000100479194
ZINC100479192

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Available files

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