Vitas-M small molecule compound
2-(1-benzyl-3,5-dimethyl-1H-pyrazol-4-yl)hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
Catalog ID
STK311391
SMILES O=C1C2C3CCC(C2C(=O)N1c1c(C)nn(c1C)Cc1ccccc1)O3
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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 C20H21N3O3 MW 351.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O3/c1-11-18(12(2)22(21-11)10-13-6-4-3-5-7-13)23-19(24)16-14-8-9-15(26-14)17(16)20(23)25/h3-7,14-17H,8-10H2,1-2H3InChIKey
ABVNLHFYPDEWBE-UHFFFAOYSA-NSynonyms
1052588-76-71052588767
2(1benzyl35dimethyl1Hpyrazol4yl)hexahydro1H47epoxyisoindole13(2H)dione
2(1benzyl35dimethylpyrazol4yl)3a45677ahexahydrooctahydro1H47epoxyisoindole13dione
CC1=C(C(=NN1CC2=CC=CC=C2)C)N3C(=O)C4C5CCC(C4C3=O)O5
InChI=1SC20H21N3O3c11118(12(2)22(2111)10136435713)2319(24)16148915(2614)17(16)20(23)25h371417H810H212H3
MFCD04137744
ZINC000226557495
ZINC000238997239
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