N-[2-[4-(azepan-1-ylcarbamoylsulfamoyl)phenyl]ethyl]-3-fluoranyl-benzamide

Systemtic Name: N-[2-[4-(azepan-1-ylcarbamoylsulfamoyl)phenyl]ethyl]-3-fluoranyl-benzamide Openeye Name: N-[2-[4-(azepan-1-ylcarbamoylsulfamoyl)phenyl]ethyl]-3-fluoro-benzamide CAS Name: N-[2-[4-[[(1-azepanylamino)-oxomethyl]sulfamoyl]phenyl]ethyl]-3-fluorobenzamide IUPAC Name: N-[2-[4-(azepan-1-ylcarbamoylsulfamoyl)phenyl]ethyl]-3-fluorobenzamide Traditional Name: N-[2-[4-(azepan-1-ylcarbamoylsulfamoyl)phenyl]ethyl]-3-fluoro-benzamide Formula: C22H27FN4O4S MolecularWeight: 462.537583

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)NC(=O)NS(=O)(=O)C2=CC=C(C=C2)CCNC(=O)C3=CC(=CC=C3)F

Isomeric SMILES

C1CCCN(CC1)NC(=O)NS(=O)(=O)C2=CC=C(C=C2)CCNC(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C22H27FN4O4S/c23-19-7-5-6-18(16-19)21(28)24-13-12-17-8-10-20(11-9-17)32(30,31)26-22(29)25-27-14-3-1-2-4-15-27/h5-11,16H,1-4,12-15H2,(H,24,28)(H2,25,26,29)