Vitas-M small molecule compound
5-chloro-2-({2-[2-(2-methylpropyl)-5-oxotetrahydrofuran-2-yl]-2-oxoethyl}amino)pyridinium
Catalog ID
STL043242
SMILES CC(CC1(CCC(=O)O1)C(=O)CNc1ccc(c[nH+]1)Cl)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 C15H20ClN2O3 MW 311.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H19ClN2O3/c1-10(2)7-15(6-5-14(20)21-15)12(19)9-18-13-4-3-11(16)8-17-13/h3-4,8,10H,5-7,9H2,1-2H3,(H,17,18)/p+1InChIKey
QAOKRRUUHQAFKN-UHFFFAOYSA-OSynonyms
5(2((5CHLOROPYRIDIN1IUM2YL)AMINO)ACETYL)5(2METHYLPROPYL)OXOLAN2ONE
5chloro2((2(2(2methylpropyl)5oxotetrahydrofuran2yl)2oxoethyl)amino)pyridinium
5chloro2((2(2isobutyl5oxotetrahydrofuran2yl)2oxoethyl)amino)pyridin1iumbromide
CC(C)CC1(CCC(=O)O1)C(=O)CNC2=(NH+)C=C(C=C2)Cl
CC(CC1(CCC(=O)O1)C(=O)CNC1=CC=C(C=(NH+)1)Cl)C(Br)
CC(CC1(CCC(=O)O1)C(=O)CNc1ccc(c(nH+)1)Cl)C
InChI=1SC15H19ClN2O3c110(2)715(6514(20)2115)12(19)918134311(16)81713h34810H579H212H3(H1718)p+1
ZINC000057440222
ZINC000057440225
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