potassium 2-[3-chloranyl-2-(diethylsulfamoyl)-7-methyl-acridin-9-yl]sulfanylethanoate

Systemtic Name: potassium 2-[3-chloranyl-2-(diethylsulfamoyl)-7-methyl-acridin-9-yl]sulfanylethanoate Openeye Name: potassium 2-[3-chloro-2-(diethylsulfamoyl)-7-methyl-acridin-9-yl]sulfanylacetate CAS Name: potassium 2-[[3-chloro-2-(diethylsulfamoyl)-7-methyl-9-acridinyl]thio]acetate IUPAC Name: potassium 2-[3-chloro-2-(diethylsulfamoyl)-7-methylacridin-9-yl]sulfanylacetate Traditional Name: potassium 2-[[3-chloro-2-(diethylsulfamoyl)-7-methyl-acridin-9-yl]thio]acetate Formula: C20H20ClKN2O4S2 MolecularWeight: 491.0651

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=C2C(=C1)C(=C3C=C(C=CC3=N2)C)SCC(=O)[O-])Cl.[K+]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=C2C(=C1)C(=C3C=C(C=CC3=N2)C)SCC(=O)[O-])Cl.[K+]

InChI

InChI=1S/C20H21ClN2O4S2.K/c1-4-23(5-2)29(26,27)18-9-14-17(10-15(18)21)22-16-7-6-12(3)8-13(16)20(14)28-11-19(24)25;/h6-10H,4-5,11H2,1-3H3,(H,24,25);/q;+1/p-1