Vitas-M small molecule compound
1-(2,4-dichlorophenyl)-3,6,6-trimethyl-1,5,6,7-tetrahydro-4H-indazol-4-one
Catalog ID
STK037632
SMILES Clc1ccc(c(c1)Cl)n1nc(c2c1CC(C)(C)CC2=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 C16H16Cl2N2O MW 323.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16Cl2N2O/c1-9-15-13(7-16(2,3)8-14(15)21)20(19-9)12-5-4-10(17)6-11(12)18/h4-6H,7-8H2,1-3H3InChIKey
MXIFDEWABPGBOL-UHFFFAOYSA-NSynonyms
425420-09-31(24dichlorophenyl)366trimethyl1567tetrahydro4Hindazol4one
1(24DICHLOROPHENYL)366TRIMETHYL57DIHYDROINDAZOL4ONE
425420093
CC1=NN(C2=C1C(=O)CC(C2)(C)C)C3=C(C=C(C=C3)Cl)Cl
Clc1ccc(c(c1)Cl)n1nc(c2c1CC(C)(C)CC2=O)C
InChI=1SC16H16Cl2N2Oc191513(716(23)814(15)21)20(199)125410(17)611(12)18h46H78H213H3
MFCD02218289
STK037632
ZINC000000111558
ZINC00111558
ZINC111558
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