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

Systemtic Name: 2-chloranyl-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]pyridine-4-carboxamide Openeye Name: 2-chloro-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]pyridine-4-carboxamide CAS Name: 2-chloro-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]-4-pyridinecarboxamide IUPAC Name: 2-chloro-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]pyridine-4-carboxamide Traditional Name: 2-chloro-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]isonicotinamide Formula: C18H19ClN4O3S MolecularWeight: 406.88646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=NCC1)NS(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CC(=NC=C3)Cl

Isomeric SMILES

C1CCC(=NCC1)NS(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CC(=NC=C3)Cl

InChI

InChI=1S/C18H19ClN4O3S/c19-16-11-13(8-10-20-16)18(24)22-14-5-4-6-15(12-14)27(25,26)23-17-7-2-1-3-9-21-17/h4-6,8,10-12H,1-3,7,9H2,(H,21,23)(H,22,24)