Vitas-M small molecule compound

(2-bromophenyl)[3-(4-methoxyphenyl)-5-(3-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]methanone

Catalog ID
STK862252
SMILES COc1ccc(cc1)C1=NN(C(C1)c1cccc(c1)[N+](=O)[O-])C(=O)c1ccccc1Br

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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 C23H18BrN3O4 MW 480.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18BrN3O4/c1-31-18-11-9-15(10-12-18)21-14-22(16-5-4-6-17(13-16)27(29)30)26(25-21)23(28)19-7-2-3-8-20(19)24/h2-13,22H,14H2,1H3
InChIKey
IGNNQTMNDHKVJK-UHFFFAOYSA-N
Synonyms
330202-24-9
(2bromophenyl)(3(4methoxyphenyl)5(3nitrophenyl)45dihydro1Hpyrazol1yl)methanone
(2BROMOPHENYL)(5(4METHOXYPHENYL)3(3NITROPHENYL)34DIHYDROPYRAZOL2YL)METHANONE
2BROMOPHENYL3(4METHOXYPHENYL)5(3NITROPHENYL)(2PYRAZOLINYL)KETONE
330202249
COC1=CC=C(C=C1)C2=NN(C(C2)C3=CC(=CC=C3)(N+)(=O)(O))C(=O)C4=CC=CC=C4Br
COc1ccc(cc1)C1=NN(C(C1)c1cccc(c1)(N+)(=O)(O))C(=O)c1ccccc1Br
InChI=1SC23H18BrN3O4c1311811915(101218)211422(1654617(1316)27(29)30)26(2521)23(28)19723820(19)24h21322H14H21H3
MFCD01932315
ZINC000009302094
ZINC000009302095

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Available files

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