Vitas-M small molecule compound
2-[1-(3,4-dichlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Catalog ID
STK315307
SMILES O=C1C2C3C=CC(C2C(=O)N1c1c(C)nn(c1C)Cc1ccc(c(c1)Cl)Cl)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)9-12-3-6-15(22)16(23)7-12)26-20(27)17-13-4-5-14(8-13)18(17)21(26)28/h3-7,13-14,17-18H,8-9H2,1-2H3InChIKey
CPULJCYJJMPUON-UHFFFAOYSA-NSynonyms
1052559-40-61052559406
2(1(34dichlorobenzyl)35dimethyl1Hpyrazol4yl)3a477atetrahydro1H47methanoisoindole13(2H)dione
CC1=C(C(=NN1CC2=CC(=C(C=C2)Cl)Cl)C)N3C(=O)C4C5CC(C4C3=O)C=C5
InChI=1SC21H19Cl2N3O2c11019(11(2)25(2410)9123615(22)16(23)712)2620(27)17134514(813)18(17)21(26)28h3713141718H89H212H3
MFCD08557113
ZINC000102024046
ZINC000247995050
Check stock
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Check stock on Vitas-MAvailable files
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