Vitas-M small molecule compound

3-bromo-N-{(1Z)-1-[4-(dimethylamino)phenyl]-3-[(2E)-2-(3-nitrobenzylidene)hydrazinyl]-3-oxoprop-1-en-2-yl}benzamide

Catalog ID
STK190780
SMILES Brc1cccc(c1)C(=O)N/C(=C\c1ccc(cc1)N(C)C)/C(=O)N/N=C/c1cccc(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 C25H22BrN5O4 MW 536.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22BrN5O4/c1-30(2)21-11-9-17(10-12-21)14-23(28-24(32)19-6-4-7-20(26)15-19)25(33)29-27-16-18-5-3-8-22(13-18)31(34)35/h3-16H,1-2H3,(H,28,32)(H,29,33)/b23-14-,27-16+
InChIKey
FPZAPOZGBISPKX-NMFBSFOHSA-N
Synonyms

3BROMON((1Z)1(4(DIMETHYLAMINO)PHENYL)3((2E)2(3NITROBENZYLIDENE)HYDRAZINYL)3OXOPROP1EN2YL)BENZAMIDE
3bromoN((Z)1(4(dimethylamino)phenyl)3((2E)2((3nitrophenyl)methylidene)hydrazinyl)3oxoprop1en2yl)benzamide
Brc1cccc(c1)C(=O)NC(=Cc1ccc(cc1)N(C)C)C(=O)NN=Cc1cccc(c1)(N+)(=O)(O)
CN(C)C1=CC=C(C=C1)C=C(C(=O)NN=CC2=CC(=CC=C2)(N+)(=O)(O))NC(=O)C3=CC(=CC=C3)Br
InChI=1SC25H22BrN5O4c130(2)2111917(101221)1423(2824(32)1964720(26)1519)25(33)2927161853822(1318)31(34)35h316H12H3(H2832)(H2933)b23142716+
MFCD08680413
ZINC000101098143
ZINC101732350

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Available files

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