Vitas-M small molecule compound
N-{3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]phenyl}-3-[(4-nitro-1H-pyrazol-1-yl)methyl]benzamide
Catalog ID
STK302534
SMILES O=C(c1cccc(c1)Cn1ncc(c1)[N+](=O)[O-])Nc1cccc(c1)Cn1nc(c(c1C)Br)C
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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 C23H21BrN6O3 MW 509.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21BrN6O3/c1-15-22(24)16(2)29(27-15)13-18-6-4-8-20(10-18)26-23(31)19-7-3-5-17(9-19)12-28-14-21(11-25-28)30(32)33/h3-11,14H,12-13H2,1-2H3,(H,26,31)InChIKey
FSPBRBOVDWBDRC-UHFFFAOYSA-NSynonyms
512826-51-6512826516
CC1=C(C(=NN1CC2=CC(=CC=C2)NC(=O)C3=CC(=CC=C3)CN4C=C(C=N4)(N+)(=O)(O))C)Br
InChI=1SC23H21BrN6O3c11522(24)16(2)29(2715)131864820(1018)2623(31)1973517(919)12281421(112528)30(32)33h31114H1213H212H3(H2631)
MFCD03468817
N(3((4bromo35dimethyl1Hpyrazol1yl)methyl)phenyl)3((4nitro1Hpyrazol1yl)methyl)benzamide
N(3((4BROMO35DIMETHYLPYRAZOL1YL)METHYL)PHENYL)3((4NITROPYRAZOL1YL)METHYL)BENZAMIDE
O=C(c1cccc(c1)Cn1ncc(c1)(N+)(=O)(O))Nc1cccc(c1)Cn1nc(c(c1C)Br)C
ZINC000002739346
ZINC02739346
ZINC2739346
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