Vitas-M small molecule compound
5-diazo-3,6,6-trimethyl-1-phenyl-1,5,6,7-tetrahydro-4H-indazol-4-one
Catalog ID
STK672544
SMILES [N-]=[N+]=C1C(=O)c2c(C)nn(c2CC1(C)C)c1ccccc1
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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 C16H16N4O MW 280.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4O/c1-10-13-12(9-16(2,3)15(18-17)14(13)21)20(19-10)11-7-5-4-6-8-11/h4-8H,9H2,1-3H3InChIKey
FUWDAYKZUPWYSJ-UHFFFAOYSA-NSynonyms
(N)=(N+)=C1C(=O)c2c(C)nn(c2CC1(C)C)c1ccccc1
5diazo366trimethyl1phenyl1567tetrahydro4Hindazol4one
5DIAZONIO366TRIMETHYL1PHENYL7HINDAZOL4OLATE
CC1=NN(C2=C1C(=C(C(C2)(C)C)(N+)#N)(O))C3=CC=CC=C3
InChI=1SC16H16N4Oc1101312(916(23)15(1817)14(13)21)20(1910)117546811h48H9H213H3
MFCD00520870
ZINC000004461576
ZINC04461576
ZINC4461576
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