N-[4-(3-morpholin-4-ium-4-ylpropylsulfamoyl)phenyl]-2-phenyl-1,2,3-triazole-4-carboxamide

Systemtic Name: N-[4-(3-morpholin-4-ium-4-ylpropylsulfamoyl)phenyl]-2-phenyl-1,2,3-triazole-4-carboxamide Openeye Name: N-[4-(3-morpholin-4-ium-4-ylpropylsulfamoyl)phenyl]-2-phenyl-triazole-4-carboxamide CAS Name: N-[4-[3-(4-morpholin-4-iumyl)propylsulfamoyl]phenyl]-2-phenyl-4-triazolecarboxamide IUPAC Name: N-[4-(3-morpholin-4-ium-4-ylpropylsulfamoyl)phenyl]-2-phenyltriazole-4-carboxamide Traditional Name: N-[4-(3-morpholin-4-ium-4-ylpropylsulfamoyl)phenyl]-2-phenyl-triazole-4-carboxamide Formula: C22H27N6O4S+ MolecularWeight: 471.55258

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=NN(N=C3)C4=CC=CC=C4

Isomeric SMILES

C1COCC[NH+]1CCCNS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=NN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H26N6O4S/c29-22(21-17-23-28(26-21)19-5-2-1-3-6-19)25-18-7-9-20(10-8-18)33(30,31)24-11-4-12-27-13-15-32-16-14-27/h1-3,5-10,17,24H,4,11-16H2,(H,25,29)/p+1