Vitas-M small molecule compound
4-bromo-2-{(E)-[2-({[(3,4,5-trimethoxyphenyl)carbonyl]amino}acetyl)hydrazinylidene]methyl}phenyl 4-nitrobenzoate (non-preferred name)
Catalog ID
STK671137
SMILES COc1c(OC)cc(cc1OC)C(=O)NCC(=O)N/N=C/c1cc(Br)ccc1OC(=O)c1ccc(cc1)[N+](=O)[O-]
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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 C26H23BrN4O9 MW 615.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23BrN4O9/c1-37-21-11-16(12-22(38-2)24(21)39-3)25(33)28-14-23(32)30-29-13-17-10-18(27)6-9-20(17)40-26(34)15-4-7-19(8-5-15)31(35)36/h4-13H,14H2,1-3H3,(H,28,33)(H,30,32)/b29-13+InChIKey
RGLUMKDKDDGTOF-VFLNYLIXSA-NSynonyms
(4bromo2((E)((2((345trimethoxybenzoyl)amino)acetyl)hydrazinylidene)methyl)phenyl)4nitrobenzoate
4bromo2((E)(2((((345trimethoxyphenyl)carbonyl)amino)acetyl)hydrazinylidene)methyl)phenyl4nitrobenzoate(nonpreferredname)
COC1=CC(=CC(=C1OC)OC)C(=O)NCC(=O)NN=CC2=C(C=CC(=C2)Br)OC(=O)C3=CC=C(C=C3)(N+)(=O)(O)
COc1c(OC)cc(cc1OC)C(=O)NCC(=O)NN=Cc1cc(Br)ccc1OC(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC26H23BrN4O9c137211116(1222(382)24(21)393)25(33)281423(32)302913171018(27)6920(17)4026(34)154719(8515)31(35)36h413H14H213H3(H2833)(H3032)b2913+
MFCD00740806
ZINC000098001542
ZINC102775496
Check stock
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Check stock on Vitas-MAvailable files
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