6-(3-phenylpiperazin-1-yl)-N-[(4-sulfamoylphenyl)methyl]pyridine-3-carboxamide

Systemtic Name: 6-(3-phenylpiperazin-1-yl)-N-[(4-sulfamoylphenyl)methyl]pyridine-3-carboxamide Openeye Name: 6-(3-phenylpiperazin-1-yl)-N-[(4-sulfamoylphenyl)methyl]pyridine-3-carboxamide CAS Name: 6-(3-phenyl-1-piperazinyl)-N-[(4-sulfamoylphenyl)methyl]-3-pyridinecarboxamide IUPAC Name: 6-(3-phenylpiperazin-1-yl)-N-[(4-sulfamoylphenyl)methyl]pyridine-3-carboxamide Traditional Name: 6-(3-phenylpiperazino)-N-(4-sulfamoylbenzyl)nicotinamide Formula: C23H25N5O3S MolecularWeight: 451.5413

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(N1)C2=CC=CC=C2)C3=NC=C(C=C3)C(=O)NCC4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

C1CN(CC(N1)C2=CC=CC=C2)C3=NC=C(C=C3)C(=O)NCC4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C23H25N5O3S/c24-32(30,31)20-9-6-17(7-10-20)14-27-23(29)19-8-11-22(26-15-19)28-13-12-25-21(16-28)18-4-2-1-3-5-18/h1-11,15,21,25H,12-14,16H2,(H,27,29)(H2,24,30,31)