Vitas-M small molecule compound

N,N'-[methanediylbis(3-nitrobenzene-4,1-diyl)]bis(3-methylbenzamide)

Catalog ID
STK430628
SMILES Cc1cccc(c1)C(=O)Nc1ccc(c(c1)[N+](=O)[O-])Cc1ccc(cc1[N+](=O)[O-])NC(=O)c1cccc(c1)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 C29H24N4O6 MW 524.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24N4O6/c1-18-5-3-7-22(13-18)28(34)30-24-11-9-20(26(16-24)32(36)37)15-21-10-12-25(17-27(21)33(38)39)31-29(35)23-8-4-6-19(2)14-23/h3-14,16-17H,15H2,1-2H3,(H,30,34)(H,31,35)
InChIKey
MZGUZRYKWIYFCK-UHFFFAOYSA-N
Synonyms

(3METHYLPHENYL)N(4((4((3METHYLPHENYL)CARBONYLAMINO)2NITROPHENYL)METHYL)3NITROPHENYL)CARBOXAMIDE
3METHYLN(4((4((3METHYLBENZOYL)AMINO)2NITROPHENYL)METHYL)3NITROPHENYL)BENZAMIDE
CC1=CC=CC(=C1)C(=O)NC2=CC(=C(C=C2)CC3=C(C=C(C=C3)NC(=O)C4=CC(=CC=C4)C)(N+)(=O)(O))(N+)(=O)(O)
Cc1cccc(c1)C(=O)Nc1ccc(c(c1)(N+)(=O)(O))Cc1ccc(cc1(N+)(=O)(O))NC(=O)c1cccc(c1)C
InChI=1SC29H24N4O6c11853722(1318)28(34)302411920(26(1624)32(36)37)1521101225(1727(21)33(38)39)3129(35)2384619(2)1423h3141617H15H212H3(H3034)(H3135)
MFCD00587477
NN(methanediylbis(3nitrobenzene41diyl))bis(3methylbenzamide)
ZINC000002766176
ZINC2766176

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Available files

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