3-phenyl-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]-1H-pyrazole-5-carboxamide

Systemtic Name: 3-phenyl-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]-1H-pyrazole-5-carboxamide Openeye Name: 3-phenyl-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]-1H-pyrazole-5-carboxamide CAS Name: 3-phenyl-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]-1H-pyrazole-5-carboxamide IUPAC Name: 3-phenyl-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]-1H-pyrazole-5-carboxamide Traditional Name: 3-phenyl-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]-1H-pyrazole-5-carboxamide Formula: C22H23N5O3S MolecularWeight: 437.51472

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=NCC1)NS(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CC(=NN3)C4=CC=CC=C4

Isomeric SMILES

C1CCC(=NCC1)NS(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CC(=NN3)C4=CC=CC=C4

InChI

InChI=1S/C22H23N5O3S/c28-22(20-15-19(25-26-20)16-8-3-1-4-9-16)24-17-10-7-11-18(14-17)31(29,30)27-21-12-5-2-6-13-23-21/h1,3-4,7-11,14-15H,2,5-6,12-13H2,(H,23,27)(H,24,28)(H,25,26)