Vitas-M small molecule compound
2-(1,3-dimethyl-1H-pyrazol-4-yl)-6-nitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
Catalog ID
STK366179
SMILES Cn1nc(c(c1)n1c(=O)c2cccc3c2c(c1=O)ccc3[N+](=O)[O-])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 C17H12N4O4 MW 336.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12N4O4/c1-9-14(8-19(2)18-9)20-16(22)11-5-3-4-10-13(21(24)25)7-6-12(15(10)11)17(20)23/h3-8H,1-2H3InChIKey
IWNMZMHNYAVOIM-UHFFFAOYSA-NSynonyms
292826-69-82(13dimethyl1Hpyrazol4yl)6nitro1Hbenzo(de)isoquinoline13(2H)dione
2(13DIMETHYLPYRAZOL4YL)6NITROBENZO(DE)ISOQUINOLINE13DIONE
292826698
CC1=NN(C=C1N2C(=O)C3=C4C(=C(C=C3)(N+)(=O)(O))C=CC=C4C2=O)C
Cn1nc(c(c1)n1c(=O)c2cccc3c2c(c1=O)ccc3(N+)(=O)(O))C
InChI=1SC17H12N4O4c1914(819(2)189)2016(22)115341013(21(24)25)7612(15(10)11)17(20)23h38H12H3
MFCD00377881
ZINC000000192521
ZINC00192521
ZINC192521
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