Vitas-M small molecule compound
3,5-bis(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-{4-[(1E)-3-oxo-3-phenylprop-1-en-1-yl]phenyl}benzamide
Catalog ID
STK019066
SMILES O=C(c1cc(cc(c1)N1C(=O)c2c(C1=O)cc(cc2)[N+](=O)[O-])N1C(=O)c2c(C1=O)cc(cc2)[N+](=O)[O-])Nc1ccc(cc1)/C=C/C(=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 C38H21N5O10 MW 707.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H21N5O10/c44-33(22-4-2-1-3-5-22)15-8-21-6-9-24(10-7-21)39-34(45)23-16-27(40-35(46)29-13-11-25(42(50)51)19-31(29)37(40)48)18-28(17-23)41-36(47)30-14-12-26(43(52)53)20-32(30)38(41)49/h1-20H,(H,39,45)/b15-8+InChIKey
XFBBERQZAXAAMZ-OVCLIPMQSA-NSynonyms
35BIS(5NITRO13DIOXO13DIHYDRO2HISOINDOL2YL)N(4((1E)3OXO3PHENYLPROP1EN1YL)PHENYL)BENZAMIDE
35BIS(5NITRO13DIOXOISOINDOL2YL)N(4((E)3OXO3PHENYLPROP1ENYL)PHENYL)BENZAMIDE
C1=CC=C(C=C1)C(=O)C=CC2=CC=C(C=C2)NC(=O)C3=CC(=CC(=C3)N4C(=O)C5=C(C4=O)C=C(C=C5)(N+)(=O)(O))N6C(=O)C7=C(C6=O)C=C(C=C7)(N+)(=O)(O)
InChI=1SC38H21N5O10c4433(224213522)158216924(10721)3934(45)231627(4035(46)29131125(42(50)51)1931(29)37(40)48)1828(1723)4136(47)30141226(43(52)53)2032(30)38(41)49h120H(H3945)b158+
MFCD00516850
O=C(c1cc(cc(c1)N1C(=O)c2c(C1=O)cc(cc2)(N+)(=O)(O))N1C(=O)c2c(C1=O)cc(cc2)(N+)(=O)(O))Nc1ccc(cc1)C=CC(=O)c1ccccc1
STK019066
ZINC000150407956
ZINC150407956
Check stock
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Check stock on Vitas-MAvailable files
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