Vitas-M small molecule compound
3-(4-bromophenyl)-8-[(4-ethylpiperazin-1-ium-1-yl)methyl]-4-oxo-4H-chromen-7-olate
Catalog ID
STK570571
SMILES CCN1CC[NH+](CC1)Cc1c([O-])ccc2c1occ(c2=O)c1ccc(cc1)Br
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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 C22H23BrN2O3 MW 443.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23BrN2O3/c1-2-24-9-11-25(12-10-24)13-18-20(26)8-7-17-21(27)19(14-28-22(17)18)15-3-5-16(23)6-4-15/h3-8,14,26H,2,9-13H2,1H3InChIKey
DINMFTIPFRHFDO-UHFFFAOYSA-NSynonyms
845627-18-13(4bromophenyl)8((4ethylpiperazin1ium1yl)methyl)4oxo4Hchromen7olate
3(4BROMOPHENYL)8((4ETHYLPIPERAZIN1IUM1YL)METHYL)4OXOCHROMEN7OLATE
3(4BROMOPHENYL)8((4ETHYLPIPERAZIN1YL)METHYL)7HYDROXYCHROMEN4ONE
3(4BROMOPHENYL)8((4ETHYLPIPERAZINYL)METHYL)7HYDROXYCHROMEN4ONE
CCN1CC(NH+)(CC1)Cc1c((O))ccc2c1occ(c2=O)c1ccc(cc1)Br
CCN1CC(NH+)(CC1)CC2=C(C=CC3=C2OC=C(C3=O)C4=CC=C(C=C4)Br)(O)
InChI=1SC22H23BrN2O3c122491125(121024)131820(26)871721(27)19(142822(17)18)153516(23)6415h381426H2913H21H3
MFCD04165840
ZINC000020358674
ZINC20358674
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