(2S)-4-methyl-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-2-[(4-methylphenyl)sulfonylamino]pentanamide

Systemtic Name: (2S)-4-methyl-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-2-[(4-methylphenyl)sulfonylamino]pentanamide Openeye Name: (2S)-4-methyl-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-2-(p-tolylsulfonylamino)pentanamide CAS Name: (2S)-4-methyl-N-[2-methyl-2-(4-morpholin-4-iumyl)propyl]-2-[(4-methylphenyl)sulfonylamino]pentanamide IUPAC Name: (2S)-4-methyl-N-(2-methyl-2-morpholin-4-ium-4-ylpropyl)-2-[(4-methylphenyl)sulfonylamino]pentanamide Traditional Name: (2S)-4-methyl-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-2-(tosylamino)valeramide Formula: C21H36N3O4S+ MolecularWeight: 426.59324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC(C)C)C(=O)NCC(C)(C)[NH+]2CCOCC2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](CC(C)C)C(=O)NCC(C)(C)[NH+]2CCOCC2

InChI

InChI=1S/C21H35N3O4S/c1-16(2)14-19(23-29(26,27)18-8-6-17(3)7-9-18)20(25)22-15-21(4,5)24-10-12-28-13-11-24/h6-9,16,19,23H,10-15H2,1-5H3,(H,22,25)/p+1/t19-/m0/s1