Vitas-M small molecule compound

2-chloro-N-{(1E)-1-[4-(diethylamino)phenyl]-3-[(2E)-2-(2-ethoxybenzylidene)hydrazinyl]-3-oxoprop-1-en-2-yl}benzamide

Catalog ID
STK034086
SMILES CCOc1ccccc1/C=N/NC(=O)/C(=C\c1ccc(cc1)N(CC)CC)/NC(=O)c1ccccc1Cl

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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 C29H31ClN4O3 MW 519.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31ClN4O3/c1-4-34(5-2)23-17-15-21(16-18-23)19-26(32-28(35)24-12-8-9-13-25(24)30)29(36)33-31-20-22-11-7-10-14-27(22)37-6-3/h7-20H,4-6H2,1-3H3,(H,32,35)(H,33,36)/b26-19+,31-20+
InChIKey
FMMSCSFTROIMHR-DVIYFVMSSA-N
Synonyms
362476-38-8
2CHLORON((1E)1(4(DIETHYLAMINO)PHENYL)3((2E)2(2ETHOXYBENZYLIDENE)HYDRAZINYL)3OXOPROP1EN2YL)BENZAMIDE
2chloroN((E)1(4(diethylamino)phenyl)3((2E)2((2ethoxyphenyl)methylidene)hydrazinyl)3oxoprop1en2yl)benzamide
2CHLORON(2(4(DIETHYLAMINO)PHENYL)1((2(2ETHOXYBENZYLIDENE)HYDRAZINO)CARBONYL)VINYL)BENZAMIDE
362476388
CCN(CC)C1=CC=C(C=C1)C=C(C(=O)NN=CC2=CC=CC=C2OCC)NC(=O)C3=CC=CC=C3Cl
CCOc1ccccc1C=NNC(=O)C(=Cc1ccc(cc1)N(CC)CC)NC(=O)c1ccccc1Cl
InChI=1SC29H31ClN4O3c1434(52)23171521(161823)1926(3228(35)2412891325(24)30)29(36)33312022117101427(22)3763h720H46H213H3(H3235)(H3336)b2619+3120+
MFCD01147822
STK034086
ZINC000008457123
ZINC33718767

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Available files

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