Vitas-M small molecule compound

3-[(4-nitro-1H-pyrazol-1-yl)methyl]-N-[1-(2,3,5,6-tetrafluorobenzyl)-1H-pyrazol-3-yl]benzamide

Catalog ID
STK963969
SMILES O=C(c1cccc(c1)Cn1ncc(c1)[N+](=O)[O-])Nc1ccn(n1)Cc1c(F)c(F)cc(c1F)F

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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 C21H14F4N6O3 MW 474.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14F4N6O3/c22-16-7-17(23)20(25)15(19(16)24)11-29-5-4-18(28-29)27-21(32)13-3-1-2-12(6-13)9-30-10-14(8-26-30)31(33)34/h1-8,10H,9,11H2,(H,27,28,32)
InChIKey
ZZOZFLOKZNXAGS-UHFFFAOYSA-N
Synonyms
512824-66-7
3((4nitro1Hpyrazol1yl)methyl)N(1(2356tetrafluorobenzyl)1Hpyrazol3yl)benzamide
3((4nitropyrazol1yl)methyl)N(1((2356tetrafluorophenyl)methyl)pyrazol3yl)benzamide
512824667
C1=CC(=CC(=C1)CN2C=C(C=N2)(N+)(=O)(O))C(=O)NC3=NN(C=C3)CC4=C(C(=CC(=C4F)F)F)F
InChI=1SC21H14F4N6O3c2216717(23)20(25)15(19(16)24)11295418(2829)2721(32)1331212(613)9301014(82630)31(33)34h1810H911H2(H272832)
MFCD03468563
O=C(c1cccc(c1)Cn1ncc(c1)(N+)(=O)(O))Nc1ccn(n1)Cc1c(F)c(F)cc(c1F)F
ZINC000000653441
ZINC00653441
ZINC653441

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Available files

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