Vitas-M small molecule compound
(3aR,7aS)-2-[1-(2-chlorobenzyl)-1H-pyrazol-3-yl]hexahydro-1H-isoindole-1,3(2H)-dione
Catalog ID
STK311055
SMILES O=C1N(c2ccn(n2)Cc2ccccc2Cl)C(=O)[C@@H]2[C@H]1CCCC2
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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 C18H18ClN3O2 MW 343.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClN3O2/c19-15-8-4-1-5-12(15)11-21-10-9-16(20-21)22-17(23)13-6-2-3-7-14(13)18(22)24/h1,4-5,8-10,13-14H,2-3,6-7,11H2/t13-,14+InChIKey
ZLNYLUJRHCJLFS-OKILXGFUSA-NSynonyms
1212142-30-7(3aR7aS)2(1((2chlorophenyl)methyl)pyrazol3yl)3a45677ahexahydroisoindole13dione
(3aR7aS)2(1(2chlorobenzyl)1Hpyrazol3yl)hexahydro1Hisoindole13(2H)dione
1212142307
C1CCC2C(C1)C(=O)N(C2=O)C3=NN(C=C3)CC4=CC=CC=C4Cl
InChI=1SC18H18ClN3O2c1915841512(15)112110916(2021)2217(23)13623714(13)18(22)24h1458101314H236711H2t1314+
MFCD04058975
O=C1N(c2ccn(n2)Cc2ccccc2Cl)C(=O)(C@@H)2(C@H)1CCCC2
ZINC000017071770
ZINC17071770
ZINC18166721
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