Vitas-M small molecule compound
propan-2-yl ({6-[(4-benzylpiperazin-1-yl)methyl]-4-oxo-4H-pyran-3-yl}oxy)acetate
Catalog ID
STL310855
SMILES CC(OC(=O)COc1coc(cc1=O)CN1CCN(CC1)Cc1ccccc1)C
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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 C22H28N2O5 MW 400.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N2O5/c1-17(2)29-22(26)16-28-21-15-27-19(12-20(21)25)14-24-10-8-23(9-11-24)13-18-6-4-3-5-7-18/h3-7,12,15,17H,8-11,13-14,16H2,1-2H3InChIKey
AGNLOKXPVMNJKD-UHFFFAOYSA-NSynonyms
1436001-32-91436001329
CC(C)OC(=O)COC1=COC(=CC1=O)CN2CCN(CC2)CC3=CC=CC=C3
InChI=1SC22H28N2O5c117(2)2922(26)162821152719(1220(21)25)142410823(91124)13186435718h37121517H811131416H212H3
isopropyl2((6((4benzylpiperazin1yl)methyl)4oxo4Hpyran3yl)oxy)acetate
MFCD23139838
propan2yl((6((4benzylpiperazin1yl)methyl)4oxo4Hpyran3yl)oxy)acetate
propan2yl2(6((4benzylpiperazin1yl)methyl)4oxopyran3yl)oxyacetate
ZINC000095473642
ZINC95473642
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