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

Systemtic Name: 5-methyl-N-[4-(3-morpholin-4-ium-4-ylpropylsulfamoyl)phenyl]-2-phenyl-1,2,3-triazole-4-carboxamide Openeye Name: 5-methyl-N-[4-(3-morpholin-4-ium-4-ylpropylsulfamoyl)phenyl]-2-phenyl-triazole-4-carboxamide CAS Name: 5-methyl-N-[4-[3-(4-morpholin-4-iumyl)propylsulfamoyl]phenyl]-2-phenyl-4-triazolecarboxamide IUPAC Name: 5-methyl-N-[4-(3-morpholin-4-ium-4-ylpropylsulfamoyl)phenyl]-2-phenyltriazole-4-carboxamide Traditional Name: 5-methyl-N-[4-(3-morpholin-4-ium-4-ylpropylsulfamoyl)phenyl]-2-phenyl-triazole-4-carboxamide Formula: C23H29N6O4S+ MolecularWeight: 485.57916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1C(=O)NC2=CC=C(C=C2)S(=O)(=O)NCCC[NH+]3CCOCC3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(N=C1C(=O)NC2=CC=C(C=C2)S(=O)(=O)NCCC[NH+]3CCOCC3)C4=CC=CC=C4

InChI

InChI=1S/C23H28N6O4S/c1-18-22(27-29(26-18)20-6-3-2-4-7-20)23(30)25-19-8-10-21(11-9-19)34(31,32)24-12-5-13-28-14-16-33-17-15-28/h2-4,6-11,24H,5,12-17H2,1H3,(H,25,30)/p+1