Vitas-M small molecule compound
2-[1-(2,6-dichlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Catalog ID
STK315056
SMILES O=C1C2C3C=CC(C2C(=O)N1c1c(C)nn(c1C)Cc1c(Cl)cccc1Cl)C3
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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 C21H19Cl2N3O2 MW 416.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19Cl2N3O2/c1-10-19(11(2)25(24-10)9-14-15(22)4-3-5-16(14)23)26-20(27)17-12-6-7-13(8-12)18(17)21(26)28/h3-7,12-13,17-18H,8-9H2,1-2H3InChIKey
AEWBQAILSBNYNQ-UHFFFAOYSA-NSynonyms
1052555-59-51052555595
2(1(26dichlorobenzyl)35dimethyl1Hpyrazol4yl)3a477atetrahydro1H47methanoisoindole13(2H)dione
CC1=C(C(=NN1CC2=C(C=CC=C2Cl)Cl)C)N3C(=O)C4C5CC(C4C3=O)C=C5
InChI=1SC21H19Cl2N3O2c11019(11(2)25(2410)91415(22)43516(14)23)2620(27)17126713(812)18(17)21(26)28h3712131718H89H212H3
MFCD08554168
ZINC000102023208
ZINC000238997323
Check stock
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Check stock on Vitas-MAvailable files
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