Vitas-M small molecule compound
2-[1-(3-methylbenzyl)-1H-pyrazol-4-yl]hexahydro-1H-isoindole-1,3(2H)-dione
Catalog ID
STL395147
SMILES Cc1cccc(c1)Cn1ncc(c1)N1C(=O)C2C(C1=O)CCCC2
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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 C19H21N3O2 MW 323.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N3O2/c1-13-5-4-6-14(9-13)11-21-12-15(10-20-21)22-18(23)16-7-2-3-8-17(16)19(22)24/h4-6,9-10,12,16-17H,2-3,7-8,11H2,1H3InChIKey
IYXDDDADSZHVFR-UHFFFAOYSA-NSynonyms
2(1((3methylphenyl)methyl)pyrazol4yl)3a45677ahexahydroisoindole13dione
2(1(3METHYLBENZYL)1HPYRAZOL4YL)HEXAHYDRO1HISOINDOLE13(2H)DIONE
CC1=CC(=CC=C1)CN2C=C(C=N2)N3C(=O)C4CCCCC4C3=O
InChI=1SC19H21N3O2c11354614(913)11211215(102021)2218(23)16723817(16)19(22)24h46910121617H237811H21H3
MFCD28952544
ZINC000018044340
ZINC000101594480
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