Vitas-M small molecule compound
5-(azepan-1-yl)-2-(4-nitrophenyl)-1,3-oxazole-4-carbonitrile
Catalog ID
STK634429
SMILES N#Cc1nc(oc1N1CCCCCC1)c1ccc(cc1)[N+](=O)[O-]
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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 C16H16N4O3 MW 312.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4O3/c17-11-14-16(19-9-3-1-2-4-10-19)23-15(18-14)12-5-7-13(8-6-12)20(21)22/h5-8H,1-4,9-10H2InChIKey
NTVRKQJIBFCCJA-UHFFFAOYSA-NSynonyms
613650-00-35(azepan1yl)2(4nitrophenyl)13oxazole4carbonitrile
5(azepan1yl)2(4nitrophenyl)oxazole4carbonitrile
613650003
C1CCCN(CC1)C2=C(N=C(O2)C3=CC=C(C=C3)(N+)(=O)(O))C#N
InChI=1SC16H16N4O3c17111416(19931241019)2315(1814)125713(8612)20(21)22h58H14910H2
MFCD03490646
N#Cc1nc(oc1N1CCCCCC1)c1ccc(cc1)(N+)(=O)(O)
ZINC000000528958
ZINC00528958
ZINC528958
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