Vitas-M small molecule compound
3-tert-butyl-N'-[(3E)-5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-1H-pyrazole-5-carbohydrazide
Catalog ID
STK030559
SMILES O=C1Nc2c(/C/1=N\NC(=O)c1[nH]nc(c1)C(C)(C)C)cc(cc2)[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 C16H16N6O4 MW 356.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N6O4/c1-16(2,3)12-7-11(18-19-12)14(23)21-20-13-9-6-8(22(25)26)4-5-10(9)17-15(13)24/h4-7H,1-3H3,(H,18,19)(H,21,23)(H,17,20,24)InChIKey
HUKXXKKLLUDPHH-UHFFFAOYSA-NSynonyms
3TERTBUTYLN((3E)5NITRO2OXO12DIHYDRO3HINDOL3YLIDENE)1HPYRAZOLE5CARBOHYDRAZIDE
5TERTBUTYLN(5NITRO2OXOINDOL3YL)1HPYRAZOLE3CARBOHYDRAZIDE
CC(C)(C)C1=CC(=NN1)C(=O)NNC2=C3C=C(C=CC3=NC2=O)(N+)(=O)(O)
InChI=1SC16H16N6O4c116(23)12711(181912)14(23)212013968(22(25)26)4510(9)1715(13)24h47H13H3(H1819)(H2123)(H172024)
MFCD08050274
O=C1Nc2c(C1=NNC(=O)c1(nH)nc(c1)C(C)(C)C)cc(cc2)(N+)(=O)(O)
STK030559
ZINC000018286188
ZINC18286188
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