Vitas-M small molecule compound
(3aR,7aS)-2-[1-(4-bromobenzyl)-1H-pyrazol-4-yl]hexahydro-1H-isoindole-1,3(2H)-dione
Catalog ID
STK311195
SMILES O=C1[C@@H]2CCCC[C@@H]2C(=O)N1c1cnn(c1)Cc1ccc(cc1)Br
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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 C18H18BrN3O2 MW 388.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18BrN3O2/c19-13-7-5-12(6-8-13)10-21-11-14(9-20-21)22-17(23)15-3-1-2-4-16(15)18(22)24/h5-9,11,15-16H,1-4,10H2/t15-,16+InChIKey
MTMZUJHDRKXAAW-IYBDPMFKSA-NSynonyms
1212306-49-4(3aR7aS)2(1(4bromobenzyl)1Hpyrazol4yl)hexahydro1Hisoindole13(2H)dione
(3aS7aR)2(1((4bromophenyl)methyl)pyrazol4yl)3a45677ahexahydroisoindole13dione
1212306494
C1CCC2C(C1)C(=O)N(C2=O)C3=CN(N=C3)CC4=CC=C(C=C4)Br
InChI=1SC18H18BrN3O2c19137512(6813)10211114(92021)2217(23)15312416(15)18(22)24h59111516H1410H2t1516+
MFCD04059364
O=C1(C@@H)2CCCC(C@@H)2C(=O)N1c1cnn(c1)Cc1ccc(cc1)Br
ZINC000018166770
ZINC18166770
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