Vitas-M small molecule compound

(4Z)-4-{3-bromo-4-[2-nitro-4-(trifluoromethyl)phenoxy]benzylidene}-1-phenylpyrazolidine-3,5-dione

Catalog ID
STK394103
SMILES O=C1NN(C(=O)/C/1=C\c1ccc(c(c1)Br)Oc1ccc(cc1[N+](=O)[O-])C(F)(F)F)c1ccccc1

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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 C23H13BrF3N3O5 MW 548.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H13BrF3N3O5/c24-17-11-13(10-16-21(31)28-29(22(16)32)15-4-2-1-3-5-15)6-8-19(17)35-20-9-7-14(23(25,26)27)12-18(20)30(33)34/h1-12H,(H,28,31)/b16-10-
InChIKey
KGFDWRDQTYASNX-YBEGLDIGSA-N
Synonyms

(4Z)4((3BROMO4(2NITRO4(TRIFLUOROMETHYL)PHENOXY)PHENYL)METHYLIDENE)1PHENYLPYRAZOLIDINE35DIONE
(4Z)4(3bromo4(2nitro4(trifluoromethyl)phenoxy)benzylidene)1phenylpyrazolidine35dione
4((3BROMO4(2NITRO4(TRIFLUOROMETHYL)PHENOXY)PHENYL)METHYLENE)1PHENYL12DIAZOLIDINE35DIONE
C1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C=C3)OC4=C(C=C(C=C4)C(F)(F)F)(N+)(=O)(O))Br)C(=O)N2
InChI=1SC23H13BrF3N3O5c24171113(101621(31)2829(22(16)32)154213515)6819(17)35209714(23(2526)27)1218(20)30(33)34h112H(H2831)b1610
MFCD03834663
O=C1NN(C(=O)C1=Cc1ccc(c(c1)Br)Oc1ccc(cc1(N+)(=O)(O))C(F)(F)F)c1ccccc1
ZINC000101938582
ZINC101938582

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Available files

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