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

Systemtic Name: 1-phenyl-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]-1,2,3-triazole-4-carboxamide Openeye Name: 1-phenyl-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]triazole-4-carboxamide CAS Name: 1-phenyl-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]-4-triazolecarboxamide IUPAC Name: 1-phenyl-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]triazole-4-carboxamide Traditional Name: 1-phenyl-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]triazole-4-carboxamide Formula: C21H22N6O3S MolecularWeight: 438.50278

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=NCC1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CN(N=N3)C4=CC=CC=C4

Isomeric SMILES

C1CCC(=NCC1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CN(N=N3)C4=CC=CC=C4

InChI

InChI=1S/C21H22N6O3S/c28-21(19-15-27(26-24-19)17-7-3-1-4-8-17)23-16-10-12-18(13-11-16)31(29,30)25-20-9-5-2-6-14-22-20/h1,3-4,7-8,10-13,15H,2,5-6,9,14H2,(H,22,25)(H,23,28)