6-[(2,5-dimethylphenyl)-methyl-sulfamoyl]-N-(3-morpholin-4-ium-4-ylpropyl)-4-oxidanylidene-1H-quinoline-3-carboxamide

Systemtic Name: 6-[(2,5-dimethylphenyl)-methyl-sulfamoyl]-N-(3-morpholin-4-ium-4-ylpropyl)-4-oxidanylidene-1H-quinoline-3-carboxamide Openeye Name: 6-[(2,5-dimethylphenyl)-methyl-sulfamoyl]-N-(3-morpholin-4-ium-4-ylpropyl)-4-oxo-1H-quinoline-3-carboxamide CAS Name: 6-[(2,5-dimethylphenyl)-methylsulfamoyl]-N-[3-(4-morpholin-4-iumyl)propyl]-4-oxo-1H-quinoline-3-carboxamide IUPAC Name: 6-[(2,5-dimethylphenyl)-methylsulfamoyl]-N-(3-morpholin-4-ium-4-ylpropyl)-4-oxo-1H-quinoline-3-carboxamide Traditional Name: 6-[(2,5-dimethylphenyl)-methyl-sulfamoyl]-4-keto-N-(3-morpholin-4-ium-4-ylpropyl)-1H-quinoline-3-carboxamide Formula: C26H33N4O5S+ MolecularWeight: 513.62902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N(C)S(=O)(=O)C2=CC3=C(C=C2)NC=C(C3=O)C(=O)NCCC[NH+]4CCOCC4

Isomeric SMILES

CC1=CC(=C(C=C1)C)N(C)S(=O)(=O)C2=CC3=C(C=C2)NC=C(C3=O)C(=O)NCCC[NH+]4CCOCC4

InChI

InChI=1S/C26H32N4O5S/c1-18-5-6-19(2)24(15-18)29(3)36(33,34)20-7-8-23-21(16-20)25(31)22(17-28-23)26(32)27-9-4-10-30-11-13-35-14-12-30/h5-8,15-17H,4,9-14H2,1-3H3,(H,27,32)(H,28,31)/p+1