Vitas-M small molecule compound
[3-(4-methoxyphenyl)-5-phenyl-4,5-dihydro-1H-pyrazol-1-yl](4-nitrophenyl)acetonitrile
Catalog ID
STK144639
SMILES COc1ccc(cc1)C1=NN(C(C1)c1ccccc1)C(c1ccc(cc1)[N+](=O)[O-])C#N
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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 C24H20N4O3 MW 412.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20N4O3/c1-31-21-13-9-17(10-14-21)22-15-23(18-5-3-2-4-6-18)27(26-22)24(16-25)19-7-11-20(12-8-19)28(29)30/h2-14,23-24H,15H2,1H3InChIKey
HBUVNOADDUOJFD-UHFFFAOYSA-NSynonyms
(3(4METHOXYPHENYL)5PHENYL45DIHYDRO1HPYRAZOL1YL)(4NITROPHENYL)ACETONITRILE
2(5(4METHOXYPHENYL)3PHENYL34DIHYDROPYRAZOL2YL)2(4NITROPHENYL)ACETONITRILE
COC1=CC=C(C=C1)C2=NN(C(C2)C3=CC=CC=C3)C(C#N)C4=CC=C(C=C4)(N+)(=O)(O)
COc1ccc(cc1)C1=NN(C(C1)c1ccccc1)C(c1ccc(cc1)(N+)(=O)(O))C#N
InChI=1SC24H20N4O3c1312113917(101421)221523(185324618)27(2622)24(1625)1971120(12819)28(29)30h2142324H15H21H3
MFCD06662771
ZINC000004593472
ZINC000102960411
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