Vitas-M small molecule compound
3-(4-chlorophenyl)-2-methyl-8-[(4-methylpiperazin-1-ium-1-yl)methyl]-4-oxo-4H-chromen-7-olate
Catalog ID
STK569851
SMILES CN1CC[NH+](CC1)Cc1c([O-])ccc2c1oc(C)c(c2=O)c1ccc(cc1)Cl
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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 C22H23ClN2O3 MW 398.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23ClN2O3/c1-14-20(15-3-5-16(23)6-4-15)21(27)17-7-8-19(26)18(22(17)28-14)13-25-11-9-24(2)10-12-25/h3-8,26H,9-13H2,1-2H3InChIKey
UXLJUUYMZSLDDZ-UHFFFAOYSA-NSynonyms
848211-76-73(4chlorophenyl)2methyl8((4methylpiperazin1ium1yl)methyl)4oxo4Hchromen7olate
CC1=C(C(=O)C2=C(O1)C(=C(C=C2)O)CN3CCN(CC3)C)C4=CC=C(C=C4)Cl
CN1CC(NH+)(CC1)Cc1c((O))ccc2c1oc(C)c(c2=O)c1ccc(cc1)Cl
InChI=1SC22H23ClN2O3c11420(153516(23)6415)21(27)177819(26)18(22(17)2814)132511924(2)101225h3826H913H212H3
MFCD04188542
ZINC000020439627
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