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

Systemtic Name: 3-phenyl-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]butanamide Openeye Name: 3-phenyl-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]butanamide CAS Name: 3-phenyl-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]butanamide IUPAC Name: 3-phenyl-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]butanamide Traditional Name: 3-phenyl-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]butyramide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC1=CC(=CC=C1)S(=O)(=O)NC2=NCCCCC2)C3=CC=CC=C3

Isomeric SMILES

CC(CC(=O)NC1=CC(=CC=C1)S(=O)(=O)NC2=NCCCCC2)C3=CC=CC=C3

InChI

InChI=1S/C22H27N3O3S/c1-17(18-9-4-2-5-10-18)15-22(26)24-19-11-8-12-20(16-19)29(27,28)25-21-13-6-3-7-14-23-21/h2,4-5,8-12,16-17H,3,6-7,13-15H2,1H3,(H,23,25)(H,24,26)