Vitas-M small molecule compound
(3aR,7aS)-2-{1-[3-(trifluoromethyl)benzyl]-1H-pyrazol-4-yl}hexahydro-1H-isoindole-1,3(2H)-dione
Catalog ID
STK311271
SMILES O=C1N(c2cnn(c2)Cc2cccc(c2)C(F)(F)F)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 C19H18F3N3O2 MW 377.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18F3N3O2/c20-19(21,22)13-5-3-4-12(8-13)10-24-11-14(9-23-24)25-17(26)15-6-1-2-7-16(15)18(25)27/h3-5,8-9,11,15-16H,1-2,6-7,10H2/t15-,16+InChIKey
LRBXYRZZIHTUCN-IYBDPMFKSA-NSynonyms
1212281-16-7(3aR7aS)2(1((3(trifluoromethyl)phenyl)methyl)pyrazol4yl)3a45677ahexahydroisoindole13dione
(3aR7aS)2(1(3(trifluoromethyl)benzyl)1Hpyrazol4yl)hexahydro1Hisoindole13(2H)dione
1212281167
C1CCC2C(C1)C(=O)N(C2=O)C3=CN(N=C3)CC4=CC(=CC=C4)C(F)(F)F
InChI=1SC19H18F3N3O2c2019(2122)1353412(813)10241114(92324)2517(26)15612716(15)18(25)27h3589111516H126710H2t1516+
MFCD04059718
O=C1N(c2cnn(c2)Cc2cccc(c2)C(F)(F)F)C(=O)(C@@H)2(C@H)1CCCC2
ZINC000018084268
ZINC18084268
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