1-[(2-morpholin-4-ylpyridin-1-ium-4-yl)methyl]-3-[(1S)-1-(4-sulfamoylphenyl)ethyl]urea

Systemtic Name: 1-[(2-morpholin-4-ylpyridin-1-ium-4-yl)methyl]-3-[(1S)-1-(4-sulfamoylphenyl)ethyl]urea Openeye Name: 1-[(2-morpholinopyridin-1-ium-4-yl)methyl]-3-[(1S)-1-(4-sulfamoylphenyl)ethyl]urea CAS Name: 1-[[2-(4-morpholinyl)-4-pyridin-1-iumyl]methyl]-3-[(1S)-1-(4-sulfamoylphenyl)ethyl]urea IUPAC Name: 1-[(2-morpholin-4-ylpyridin-1-ium-4-yl)methyl]-3-[(1S)-1-(4-sulfamoylphenyl)ethyl]urea Traditional Name: 1-[(2-morpholinopyridin-1-ium-4-yl)methyl]-3-[(1S)-1-(4-sulfamoylphenyl)ethyl]urea Formula: C19H26N5O4S+ MolecularWeight: 420.50584

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)S(=O)(=O)N)NC(=O)NCC2=CC(=[NH+]C=C2)N3CCOCC3

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)S(=O)(=O)N)NC(=O)NCC2=CC(=[NH+]C=C2)N3CCOCC3

InChI

InChI=1S/C19H25N5O4S/c1-14(16-2-4-17(5-3-16)29(20,26)27)23-19(25)22-13-15-6-7-21-18(12-15)24-8-10-28-11-9-24/h2-7,12,14H,8-11,13H2,1H3,(H2,20,26,27)(H2,22,23,25)/p+1/t14-/m0/s1