3-[methyl-(4-methylphenyl)sulfamoyl]-N-[(2S)-2-morpholin-4-ium-4-yl-2-thiophen-2-yl-ethyl]benzamide

Systemtic Name: 3-[methyl-(4-methylphenyl)sulfamoyl]-N-[(2S)-2-morpholin-4-ium-4-yl-2-thiophen-2-yl-ethyl]benzamide Openeye Name: 3-[methyl(p-tolyl)sulfamoyl]-N-[(2S)-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]benzamide CAS Name: 3-[methyl-(4-methylphenyl)sulfamoyl]-N-[(2S)-2-(4-morpholin-4-iumyl)-2-thiophen-2-ylethyl]benzamide IUPAC Name: 3-[methyl-(4-methylphenyl)sulfamoyl]-N-[(2S)-2-morpholin-4-ium-4-yl-2-thiophen-2-ylethyl]benzamide Traditional Name: 3-[methyl(p-tolyl)sulfamoyl]-N-[(2S)-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]benzamide Formula: C25H30N3O4S2+ MolecularWeight: 500.6534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(C)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCC(C3=CC=CS3)[NH+]4CCOCC4

Isomeric SMILES

CC1=CC=C(C=C1)N(C)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC[C@@H](C3=CC=CS3)[NH+]4CCOCC4

InChI

InChI=1S/C25H29N3O4S2/c1-19-8-10-21(11-9-19)27(2)34(30,31)22-6-3-5-20(17-22)25(29)26-18-23(24-7-4-16-33-24)28-12-14-32-15-13-28/h3-11,16-17,23H,12-15,18H2,1-2H3,(H,26,29)/p+1/t23-/m0/s1