Vitas-M small molecule compound
5-amino-1-[(3-nitrophenyl)carbonyl]-1H-pyrazole-3,4-dicarbonitrile
Catalog ID
STL049649
SMILES N#Cc1nn(c(c1C#N)N)C(=O)c1cccc(c1)[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 C12H6N6O3 MW 282.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H6N6O3/c13-5-9-10(6-14)16-17(11(9)15)12(19)7-2-1-3-8(4-7)18(20)21/h1-4H,15H2InChIKey
XMSHPOCSYZBKSD-UHFFFAOYSA-NSynonyms
716341-04-75amino1((3nitrophenyl)carbonyl)1Hpyrazole34dicarbonitrile
5amino1(3nitrobenzoyl)1Hpyrazole34dicarbonitrile
5AMINO1(3NITROBENZOYL)PYRAZOLE34DICARBONITRILE
716341047
C1=CC(=CC(=C1)(N+)(=O)(O))C(=O)N2C(=C(C(=N2)C#N)C#N)N
InChI=1SC12H6N6O3c135910(614)1617(11(9)15)12(19)72138(47)18(20)21h14H15H2
MFCD04164991
N#Cc1nn(c(c1C#N)N)C(=O)c1cccc(c1)(N+)(=O)(O)
ZINC000002411526
ZINC02411526
ZINC2411526
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