Vitas-M small molecule compound
3-benzyl-4,8-dimethyl-6-[(4-methylpiperazin-1-ium-1-yl)methyl]-2-oxo-2H-chromen-7-olate
Catalog ID
STK620390
SMILES CN1CC[NH+](CC1)Cc1cc2c(c(c1[O-])C)oc(=O)c(c2C)Cc1ccccc1
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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 C24H28N2O3 MW 392.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N2O3/c1-16-20-14-19(15-26-11-9-25(3)10-12-26)22(27)17(2)23(20)29-24(28)21(16)13-18-7-5-4-6-8-18/h4-8,14,27H,9-13,15H2,1-3H3InChIKey
FRFZBWZEROHTFM-UHFFFAOYSA-NSynonyms
929810-71-93benzyl48dimethyl6((4methylpiperazin1ium1yl)methyl)2oxo2Hchromen7olate
3benzyl48dimethyl6((4methylpiperazin1ium1yl)methyl)2oxochromen7olate
CC1=C(C(=O)OC2=C(C(=C(C=C12)C(NH+)3CCN(CC3)C)(O))C)CC4=CC=CC=C4
CN1CC(NH+)(CC1)Cc1cc2c(c(c1(O))C)oc(=O)c(c2C)Cc1ccccc1
InChI=1SC24H28N2O3c116201419(152611925(3)101226)22(27)17(2)23(20)2924(28)21(16)13187546818h481427H91315H213H3
ZINC20625266
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