Vitas-M small molecule compound
2-[1-(naphthalen-1-ylmethyl)-1H-pyrazol-3-yl]hexahydro-1H-isoindole-1,3(2H)-dione
Catalog ID
STL391499
SMILES O=C1N(c2ccn(n2)Cc2cccc3c2cccc3)C(=O)C2C1CCCC2
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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 C22H21N3O2 MW 359.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O2/c26-21-18-10-3-4-11-19(18)22(27)25(21)20-12-13-24(23-20)14-16-8-5-7-15-6-1-2-9-17(15)16/h1-2,5-9,12-13,18-19H,3-4,10-11,14H2InChIKey
DBJJINOPVJGJFX-UHFFFAOYSA-NSynonyms
2(1(naphthalen1ylmethyl)1Hpyrazol3yl)hexahydro1Hisoindole13(2H)dione
2(1(naphthalen1ylmethyl)pyrazol3yl)3a45677ahexahydroisoindole13dione
C1CCC2C(C1)C(=O)N(C2=O)C3=NN(C=C3)CC4=CC=CC5=CC=CC=C54
InChI=1SC22H21N3O2c26211810341119(18)22(27)25(21)20121324(2320)141685715612917(15)16h125912131819H34101114H2
MFCD28952521
ZINC000017074125
ZINC000101592579
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