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

Systemtic Name: 1-[(2S)-2-morpholin-4-ium-4-yl-2-thiophen-2-yl-ethyl]-3-[2-(4-sulfamoylphenyl)ethyl]urea Openeye Name: 1-[(2S)-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]-3-[2-(4-sulfamoylphenyl)ethyl]urea CAS Name: 1-[(2S)-2-(4-morpholin-4-iumyl)-2-thiophen-2-ylethyl]-3-[2-(4-sulfamoylphenyl)ethyl]urea IUPAC Name: 1-[(2S)-2-morpholin-4-ium-4-yl-2-thiophen-2-ylethyl]-3-[2-(4-sulfamoylphenyl)ethyl]urea Traditional Name: 1-[(2S)-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]-3-[2-(4-sulfamoylphenyl)ethyl]urea Formula: C19H27N4O4S2+ MolecularWeight: 439.57208

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1C(CNC(=O)NCCC2=CC=C(C=C2)S(=O)(=O)N)C3=CC=CS3

Isomeric SMILES

C1COCC[NH+]1[C@@H](CNC(=O)NCCC2=CC=C(C=C2)S(=O)(=O)N)C3=CC=CS3

InChI

InChI=1S/C19H26N4O4S2/c20-29(25,26)16-5-3-15(4-6-16)7-8-21-19(24)22-14-17(18-2-1-13-28-18)23-9-11-27-12-10-23/h1-6,13,17H,7-12,14H2,(H2,20,25,26)(H2,21,22,24)/p+1/t17-/m0/s1