Vitas-M small molecule compound
3,5-bis(3,4-dimethylphenyl)-4-methyl-1-(3-nitrobenzyl)-1H-pyrazole
Catalog ID
STK314227
SMILES Cc1cc(ccc1C)c1n(Cc2cccc(c2)[N+](=O)[O-])nc(c1C)c1ccc(c(c1)C)C
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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 C27H27N3O2 MW 425.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N3O2/c1-17-9-11-23(13-19(17)3)26-21(5)27(24-12-10-18(2)20(4)14-24)29(28-26)16-22-7-6-8-25(15-22)30(31)32/h6-15H,16H2,1-5H3InChIKey
LLSQLEKDRYPSRM-UHFFFAOYSA-NSynonyms
1006995-56-71006995567
35bis(34dimethylphenyl)4methyl1((3nitrophenyl)methyl)pyrazole
35bis(34dimethylphenyl)4methyl1(3nitrobenzyl)1Hpyrazole
CC1=C(C=C(C=C1)C2=C(C(=NN2CC3=CC(=CC=C3)(N+)(=O)(O))C4=CC(=C(C=C4)C)C)C)C
Cc1cc(ccc1C)c1n(Cc2cccc(c2)(N+)(=O)(O))nc(c1C)c1ccc(c(c1)C)C
InChI=1SC27H27N3O2c11791123(1319(17)3)2621(5)27(24121018(2)20(4)1424)29(2826)162276825(1522)30(31)32h615H16H215H3
MFCD08552758
ZINC000002733562
ZINC02733562
ZINC2733562
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