Vitas-M small molecule compound

2-methoxy-4-[(E)-{2-[4-(morpholin-4-yl)-6-(piperidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene}methyl]phenyl 4-fluorobenzenesulfonate

Catalog ID
STK318019
SMILES COc1cc(/C=N/Nc2nc(nc(n2)N2CCOCC2)N2CCCCC2)ccc1OS(=O)(=O)c1ccc(cc1)F

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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 C26H30FN7O5S MW 571.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30FN7O5S/c1-37-23-17-19(5-10-22(23)39-40(35,36)21-8-6-20(27)7-9-21)18-28-32-24-29-25(33-11-3-2-4-12-33)31-26(30-24)34-13-15-38-16-14-34/h5-10,17-18H,2-4,11-16H2,1H3,(H,29,30,31,32)/b28-18+
InChIKey
FFCPSMKKGVNKSK-MTDXEUNCSA-N
Synonyms

(2methoxy4((E)((4morpholin4yl6piperidin1yl135triazin2yl)hydrazinylidene)methyl)phenyl)4fluorobenzenesulfonate
2methoxy4((E)(2(4(morpholin4yl)6(piperidin1yl)135triazin2yl)hydrazinylidene)methyl)phenyl4fluorobenzenesulfonate
4((1E)2((6MORPHOLIN4YL4PIPERIDYL(135TRIAZIN2YL))AMINO)2AZAVINYL)2METHOXYPHENYL4FLUOROBENZENESULFONATE
COC1=C(C=CC(=C1)C=NNC2=NC(=NC(=N2)N3CCOCC3)N4CCCCC4)OS(=O)(=O)C5=CC=C(C=C5)F
COc1cc(C=NNc2nc(nc(n2)N2CCOCC2)N2CCCCC2)ccc1OS(=O)(=O)c1ccc(cc1)F
InChI=1SC26H30FN7O5Sc137231719(51022(23)3940(3536)218620(27)7921)182832242925(33113241233)3126(3024)34131538161434h5101718H241116H21H3(H29303132)b2818+
MFCD04071138
ZINC000100954184
ZINC101991394

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Available files

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