Vitas-M small molecule compound
2-(1-benzyl-4-chloro-1H-pyrazol-3-yl)hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
Catalog ID
STK311546
SMILES O=C1C2C3CCC(C2C(=O)N1c1nn(cc1Cl)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 C18H16ClN3O3 MW 357.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16ClN3O3/c19-11-9-21(8-10-4-2-1-3-5-10)20-16(11)22-17(23)14-12-6-7-13(25-12)15(14)18(22)24/h1-5,9,12-15H,6-8H2InChIKey
JGRCKUHDLGBJIH-UHFFFAOYSA-NSynonyms
1052569-62-61052569626
2(1benzyl4chloro1Hpyrazol3yl)hexahydro1H47epoxyisoindole13(2H)dione
2(1benzyl4chloropyrazol3yl)3a45677ahexahydrooctahydro1H47epoxyisoindole13dione
C1CC2C3C(C1O2)C(=O)N(C3=O)C4=NN(C=C4Cl)CC5=CC=CC=C5
InChI=1SC18H16ClN3O3c1911921(8104213510)2016(11)2217(23)14126713(2512)15(14)18(22)24h1591215H68H2
MFCD04138173
ZINC000226558711
ZINC000239121078
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