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

Systemtic Name: 6-[methyl-(4-propan-2-ylphenyl)sulfamoyl]-N-(3-morpholin-4-ium-4-ylpropyl)-4-oxidanylidene-1H-quinoline-3-carboxamide Openeye Name: 6-[(4-isopropylphenyl)-methyl-sulfamoyl]-N-(3-morpholin-4-ium-4-ylpropyl)-4-oxo-1H-quinoline-3-carboxamide CAS Name: 6-[methyl-(4-propan-2-ylphenyl)sulfamoyl]-N-[3-(4-morpholin-4-iumyl)propyl]-4-oxo-1H-quinoline-3-carboxamide IUPAC Name: 6-[methyl-(4-propan-2-ylphenyl)sulfamoyl]-N-(3-morpholin-4-ium-4-ylpropyl)-4-oxo-1H-quinoline-3-carboxamide Traditional Name: 4-keto-6-[methyl(p-cumenyl)sulfamoyl]-N-(3-morpholin-4-ium-4-ylpropyl)-1H-quinoline-3-carboxamide Formula: C27H35N4O5S+ MolecularWeight: 527.6556

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H34N4O5S/c1-19(2)20-5-7-21(8-6-20)30(3)37(34,35)22-9-10-25-23(17-22)26(32)24(18-29-25)27(33)28-11-4-12-31-13-15-36-16-14-31/h5-10,17-19H,4,11-16H2,1-3H3,(H,28,33)(H,29,32)/p+1