Vitas-M small molecule compound
4-[(E)-{2-[(4-{[4-(2-methoxyphenyl)piperazin-1-yl]methyl}phenyl)carbonyl]hydrazinylidene}methyl]benzoic acid
Catalog ID
STK393985
SMILES COc1ccccc1N1CCN(CC1)Cc1ccc(cc1)C(=O)N/N=C/c1ccc(cc1)C(=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 C27H28N4O4 MW 472.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4O4/c1-35-25-5-3-2-4-24(25)31-16-14-30(15-17-31)19-21-8-10-22(11-9-21)26(32)29-28-18-20-6-12-23(13-7-20)27(33)34/h2-13,18H,14-17,19H2,1H3,(H,29,32)(H,33,34)/b28-18+InChIKey
XMWUIXGGQXJALY-MTDXEUNCSA-NSynonyms
4((1E)2((4((4(2METHOXYPHENYL)PIPERAZINYL)METHYL)PHENYL)CARBONYLAMINO)2AZAVINYL)BENZOICACID
4((E)((4((4(2methoxyphenyl)piperazin1ium1yl)methyl)benzoyl)hydrazinylidene)methyl)benzoate
4((E)(2((4((4(2METHOXYPHENYL)PIPERAZIN1YL)METHYL)PHENYL)CARBONYL)HYDRAZINYLIDENE)METHYL)BENZOICACID
COC1=CC=CC=C1N2CC(NH+)(CC2)CC3=CC=C(C=C3)C(=O)NN=CC4=CC=C(C=C4)C(=O)(O)
COc1ccccc1N1CCN(CC1)Cc1ccc(cc1)C(=O)NN=Cc1ccc(cc1)C(=O)O
InChI=1SC27H28N4O4c13525532424(25)31161430(151731)192181022(11921)26(32)2928182061223(13720)27(33)34h21318H141719H21H3(H2932)(H3334)b2818+
MFCD02067327
ZINC000004064078
ZINC33890990
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