N-[4-(3-morpholin-4-ium-4-ylpropylsulfamoyl)phenyl]-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-[4-(3-morpholin-4-ium-4-ylpropylsulfamoyl)phenyl]-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-[4-(3-morpholin-4-ium-4-ylpropylsulfamoyl)phenyl]-1-phenyl-pyrazole-4-carboxamide CAS Name: N-[4-[3-(4-morpholin-4-iumyl)propylsulfamoyl]phenyl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-[4-(3-morpholin-4-ium-4-ylpropylsulfamoyl)phenyl]-1-phenylpyrazole-4-carboxamide Traditional Name: N-[4-(3-morpholin-4-ium-4-ylpropylsulfamoyl)phenyl]-1-phenyl-pyrazole-4-carboxamide Formula: C23H28N5O4S+ MolecularWeight: 470.56452

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N5O4S/c29-23(19-17-24-28(18-19)21-5-2-1-3-6-21)26-20-7-9-22(10-8-20)33(30,31)25-11-4-12-27-13-15-32-16-14-27/h1-3,5-10,17-18,25H,4,11-16H2,(H,26,29)/p+1