Vitas-M small molecule compound
1-(5-chloro-2-methoxyphenyl)-3-methyl-6-phenyl-1,5,6,7-tetrahydro-4H-indazol-4-one
Catalog ID
STK772254
SMILES COc1ccc(cc1n1nc(c2c1CC(CC2=O)c1ccccc1)C)Cl
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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 C21H19ClN2O2 MW 366.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClN2O2/c1-13-21-18(10-15(11-19(21)25)14-6-4-3-5-7-14)24(23-13)17-12-16(22)8-9-20(17)26-2/h3-9,12,15H,10-11H2,1-2H3InChIKey
MXAYUGPVBMYVDT-UHFFFAOYSA-NSynonyms
1(5chloro2methoxyphenyl)3methyl6phenyl1567tetrahydro4Hindazol4one
1(5CHLORO2METHOXYPHENYL)3METHYL6PHENYL67DIHYDRO5HINDAZOL4ONE
CC1=NN(C2=C1C(=O)CC(C2)C3=CC=CC=C3)C4=C(C=CC(=C4)Cl)OC
InChI=1SC21H19ClN2O2c1132118(1015(1119(21)25)146435714)24(2313)171216(22)8920(17)262h391215H1011H212H3
MFCD03768629
ZINC000001076583
ZINC000001076584
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