Vitas-M small molecule compound
3,5-bis(3,4-dimethoxyphenyl)-4-methyl-1-(3-nitrobenzyl)-1H-pyrazole
Catalog ID
STL397077
SMILES COc1cc(ccc1OC)c1nn(c(c1C)c1ccc(c(c1)OC)OC)Cc1cccc(c1)[N+](=O)[O-]
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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 C27H27N3O6 MW 489.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N3O6/c1-17-26(19-9-11-22(33-2)24(14-19)35-4)28-29(16-18-7-6-8-21(13-18)30(31)32)27(17)20-10-12-23(34-3)25(15-20)36-5/h6-15H,16H2,1-5H3InChIKey
VRWOIEIFQJLYOA-UHFFFAOYSA-NSynonyms
1007343-81-81007343818
35bis(34dimethoxyphenyl)4methyl1((3nitrophenyl)methyl)pyrazole
35BIS(34DIMETHOXYPHENYL)4METHYL1(3NITROBENZYL)1HPYRAZOLE
CC1=C(N(N=C1C2=CC(=C(C=C2)OC)OC)CC3=CC(=CC=C3)(N+)(=O)(O))C4=CC(=C(C=C4)OC)OC
COc1cc(ccc1OC)c1nn(c(c1C)c1ccc(c(c1)OC)OC)Cc1cccc(c1)(N+)(=O)(O)
InChI=1SC27H27N3O6c11726(1991122(332)24(1419)354)2829(161876821(1318)30(31)32)27(17)20101223(343)25(1520)365h615H16H215H3
MFCD08551711
ZINC000022747491
ZINC22747491
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