Vitas-M small molecule compound
methyl 3-(3-hydroxy-6-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-4-oxo-4H-pyran-2-yl)-3-[5-(4-sulfamoylphenyl)furan-2-yl]propanoate
Catalog ID
STL493789
SMILES COC(=O)CC(c1oc(CN2CCN(CC2)c2ccc(cc2)OC)cc(=O)c1O)c1ccc(o1)c1ccc(cc1)S(=O)(=O)N
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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 C31H33N3O9S MW 623.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H33N3O9S/c1-40-22-7-5-21(6-8-22)34-15-13-33(14-16-34)19-23-17-26(35)30(37)31(42-23)25(18-29(36)41-2)28-12-11-27(43-28)20-3-9-24(10-4-20)44(32,38)39/h3-12,17,25,37H,13-16,18-19H2,1-2H3,(H2,32,38,39)InChIKey
ZBZRYSIQUGETMU-UHFFFAOYSA-NSynonyms
COC1=CC=C(C=C1)N2CCN(CC2)CC3=CC(=O)C(=C(O3)C(CC(=O)OC)C4=CC=C(O4)C5=CC=C(C=C5)S(=O)(=O)N)O
InChI=1SC31H33N3O9Sc140227521(6822)34151333(141634)19231726(35)30(37)31(4223)25(1829(36)412)28121127(4328)203924(10420)44(3238)39h312172537H13161819H212H3(H2323839)
methyl3(3hydroxy6((4(4methoxyphenyl)piperazin1yl)methyl)4oxo4Hpyran2yl)3(5(4sulfamoylphenyl)furan2yl)propanoate
methyl3(3hydroxy6((4(4methoxyphenyl)piperazin1yl)methyl)4oxopyran2yl)3(5(4sulfamoylphenyl)furan2yl)propanoate
MFCD29057994
ZINC000253414929
ZINC000253414930
Check stock
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Check stock on Vitas-MAvailable files
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