Vitas-M small molecule compound

N-{(1Z)-3-[(2-methoxyethyl)amino]-1-[5-(3-nitrophenyl)furan-2-yl]-3-oxoprop-1-en-2-yl}benzamide

Catalog ID
STK861814
SMILES COCCNC(=O)/C(=C/c1ccc(o1)c1cccc(c1)[N+](=O)[O-])/NC(=O)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 C23H21N3O6 MW 435.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O6/c1-31-13-12-24-23(28)20(25-22(27)16-6-3-2-4-7-16)15-19-10-11-21(32-19)17-8-5-9-18(14-17)26(29)30/h2-11,14-15H,12-13H2,1H3,(H,24,28)(H,25,27)/b20-15-
InChIKey
OYVNUDWBVZUXSH-HKWRFOASSA-N
Synonyms

COCCNC(=O)C(=CC1=CC=C(O1)C2=CC(=CC=C2)(N+)(=O)(O))NC(=O)C3=CC=CC=C3
COCCNC(=O)C(=Cc1ccc(o1)c1cccc(c1)(N+)(=O)(O))NC(=O)c1ccccc1
InChI=1SC23H21N3O6c13113122423(28)20(2522(27)166324716)1519101121(3219)1785918(1417)26(29)30h2111415H1213H21H3(H2428)(H2527)b2015
MFCD01458946
N((1Z)3((2methoxyethyl)amino)1(5(3nitrophenyl)furan2yl)3oxoprop1en2yl)benzamide
N((Z)3(2METHOXYETHYLAMINO)1(5(3NITROPHENYL)FURAN2YL)3OXOPROP1EN2YL)BENZAMIDE
ZINC000002834719
ZINC000026964530
ZINC02834719
ZINC2834719

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Available files

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