Vitas-M small molecule compound

N-(2-{[(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)acetyl]amino}ethyl)-3-(4-fluorophenyl)-1,2,4-oxadiazole-5-carboxamide

Catalog ID
STK782217
SMILES O=C(Cn1nc(c(c1C)Br)[N+](=O)[O-])NCCNC(=O)c1onc(n1)c1ccc(cc1)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 C17H15BrFN7O5 MW 496.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15BrFN7O5/c1-9-13(18)15(26(29)30)23-25(9)8-12(27)20-6-7-21-16(28)17-22-14(24-31-17)10-2-4-11(19)5-3-10/h2-5H,6-8H2,1H3,(H,20,27)(H,21,28)
InChIKey
KCEXNNLTZAKCAV-UHFFFAOYSA-N
Synonyms

CC1=C(C(=NN1CC(=O)NCCNC(=O)C2=NC(=NO2)C3=CC=C(C=C3)F)(N+)(=O)(O))Br
InChI=1SC17H15BrFN7O5c1913(18)15(26(29)30)2325(9)812(27)20672116(28)172214(243117)102411(19)5310h25H68H21H3(H2027)(H2128)
MFCD06017221
N(2(((4bromo5methyl3nitro1Hpyrazol1yl)acetyl)amino)ethyl)3(4fluorophenyl)124oxadiazole5carboxamide
N(2((2(4BROMO5METHYL3NITROPYRAZOL1YL)ACETYL)AMINO)ETHYL)3(4FLUOROPHENYL)124OXADIAZOLE5CARBOXAMIDE
O=C(Cn1nc(c(c1C)Br)(N+)(=O)(O))NCCNC(=O)c1onc(n1)c1ccc(cc1)F
ZINC000012372254
ZINC12372254

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Available files

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