Vitas-M small molecule compound

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

Catalog ID
STK513925
SMILES CN(c1ccc(cc1)/C=C(\C(=O)N/N=C/c1ccc(c(c1)Cl)Cl)/NC(=O)c1ccccc1)C

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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 C25H22Cl2N4O2 MW 481.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22Cl2N4O2/c1-31(2)20-11-8-17(9-12-20)15-23(29-24(32)19-6-4-3-5-7-19)25(33)30-28-16-18-10-13-21(26)22(27)14-18/h3-16H,1-2H3,(H,29,32)(H,30,33)/b23-15+,28-16+
InChIKey
HNHIMKCYJWPGFO-AJSAZLRBSA-N
Synonyms

CN(C)C1=CC=C(C=C1)C=C(C(=O)NN=CC2=CC(=C(C=C2)Cl)Cl)NC(=O)C3=CC=CC=C3
CN(c1ccc(cc1)C=C(C(=O)NN=Cc1ccc(c(c1)Cl)Cl)NC(=O)c1ccccc1)C
InChI=1SC25H22Cl2N4O2c131(2)2011817(91220)1523(2924(32)196435719)25(33)30281618101321(26)22(27)1418h316H12H3(H2932)(H3033)b2315+2816+
MFCD01146859
N((1E)3((2E)2(34dichlorobenzylidene)hydrazinyl)1(4(dimethylamino)phenyl)3oxoprop1en2yl)benzamide
N((E)3((2E)2((34dichlorophenyl)methylidene)hydrazinyl)1(4(dimethylamino)phenyl)3oxoprop1en2yl)benzamide
ZINC000036235415
ZINC98021179

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.