Vitas-M small molecule compound

N,N'-(benzene-1,4-diylbis{[(1E)-3-oxoprop-1-ene-1,3-diyl]benzene-3,1-diyl})bis(2-methylpropanamide)

Catalog ID
STK223176
SMILES O=C(C(C)C)Nc1cccc(c1)C(=O)/C=C/c1ccc(cc1)/C=C/C(=O)c1cccc(c1)NC(=O)C(C)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 C32H32N2O4 MW 508.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H32N2O4/c1-21(2)31(37)33-27-9-5-7-25(19-27)29(35)17-15-23-11-13-24(14-12-23)16-18-30(36)26-8-6-10-28(20-26)34-32(38)22(3)4/h5-22H,1-4H3,(H,33,37)(H,34,38)/b17-15+,18-16+
InChIKey
TXPFUGRPRURUCL-YTEMWHBBSA-N
Synonyms
376379-02-1
2methylN(3((2E)3(4((1E)3(3(2methylpropanamido)phenyl)3oxoprop1en1yl)phenyl)prop2enoyl)phenyl)propanamide
2METHYLN(3((E)3(4((E)3(3(2METHYLPROPANOYLAMINO)PHENYL)3OXOPROP1ENYL)PHENYL)PROP2ENOYL)PHENYL)PROPANAMIDE
376379021
CC(C)C(=O)NC1=CC=CC(=C1)C(=O)C=CC2=CC=C(C=C2)C=CC(=O)C3=CC(=CC=C3)NC(=O)C(C)C
InChI=1SC32H32N2O4c121(2)31(37)332795725(1927)29(35)171523111324(141223)161830(36)26861028(2026)3432(38)22(3)4h522H14H3(H3337)(H3438)b1715+1816+
MFCD01973929
NN(benzene14diylbis(((1E)3oxoprop1ene13diyl)benzene31diyl))bis(2methylpropanamide)
O=C(C(C)C)Nc1cccc(c1)C(=O)C=Cc1ccc(cc1)C=CC(=O)c1cccc(c1)NC(=O)C(C)C
ZINC000010060510
ZINC10060510

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Available files

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