Vitas-M small molecule compound
N-(2-{[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)acetyl]amino}ethyl)-3-(thiophen-2-yl)-1,2,4-oxadiazole-5-carboxamide
Catalog ID
STK692044
SMILES O=C(Cn1nc(c(c1C)Br)C)NCCNC(=O)c1onc(n1)c1cccs1
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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 C16H17BrN6O3S MW 453.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17BrN6O3S/c1-9-13(17)10(2)23(21-9)8-12(24)18-5-6-19-15(25)16-20-14(22-26-16)11-4-3-7-27-11/h3-4,7H,5-6,8H2,1-2H3,(H,18,24)(H,19,25)InChIKey
BHOPBYHZNNQQNN-UHFFFAOYSA-NSynonyms
1006334-02-61006334026
CC1=C(C(=NN1CC(=O)NCCNC(=O)C2=NC(=NO2)C3=CC=CS3)C)Br
InChI=1SC16H17BrN6O3Sc1913(17)10(2)23(219)812(24)18561915(25)162014(222616)114372711h347H568H212H3(H1824)(H1925)
MFCD08093348
N(2(((4bromo35dimethyl1Hpyrazol1yl)acetyl)amino)ethyl)3(thiophen2yl)124oxadiazole5carboxamide
N(2((2(4bromo35dimethylpyrazol1yl)acetyl)amino)ethyl)3thiophen2yl124oxadiazole5carboxamide
ZINC000015082100
ZINC15082100
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