Vitas-M small molecule compound
1,7-dibenzyl-3,5-dimethyl-4-(4-nitrophenyl)-4,7-dihydro-1H-pyrano[2,3-c:6,5-c']dipyrazole
Catalog ID
STK334133
SMILES Cc1nn(c2c1C(c1ccc(cc1)[N+](=O)[O-])c1c(O2)n(nc1C)Cc1ccccc1)Cc1ccccc1
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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 C29H25N5O3 MW 491.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25N5O3/c1-19-25-27(23-13-15-24(16-14-23)34(35)36)26-20(2)31-33(18-22-11-7-4-8-12-22)29(26)37-28(25)32(30-19)17-21-9-5-3-6-10-21/h3-16,27H,17-18H2,1-2H3InChIKey
LVCMVRZJJMJASW-UHFFFAOYSA-NSynonyms
17dibenzyl35dimethyl4(4nitrophenyl)47dihydro1Hpyrano(23c65c)dipyrazole
CC1=NN(C2=C1C(C3=C(O2)N(N=C3C)CC4=CC=CC=C4)C5=CC=C(C=C5)(N+)(=O)(O))CC6=CC=CC=C6
Cc1nn(c2c1C(c1ccc(cc1)(N+)(=O)(O))c1c(O2)n(nc1C)Cc1ccccc1)Cc1ccccc1
InChI=1SC29H25N5O3c1192527(23131524(161423)34(35)36)2620(2)3133(1822117481222)29(26)3728(25)32(3019)172195361021h31627H1718H212H3
MFCD09963482
ZINC000018197006
ZINC18197006
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