3,5-dimethyl-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]-1,2-oxazole-4-sulfonamide

Systemtic Name: 3,5-dimethyl-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]-1,2-oxazole-4-sulfonamide Openeye Name: 3,5-dimethyl-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]isoxazole-4-sulfonamide CAS Name: 3,5-dimethyl-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]-4-isoxazolesulfonamide IUPAC Name: 3,5-dimethyl-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]-1,2-oxazole-4-sulfonamide Traditional Name: 3,5-dimethyl-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]isoxazole-4-sulfonamide Formula: C17H22N4O5S2 MolecularWeight: 426.51038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)NC2=CC(=CC=C2)S(=O)(=O)NC3=NCCCCC3

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)NC2=CC(=CC=C2)S(=O)(=O)NC3=NCCCCC3

InChI

InChI=1S/C17H22N4O5S2/c1-12-17(13(2)26-19-12)28(24,25)20-14-7-6-8-15(11-14)27(22,23)21-16-9-4-3-5-10-18-16/h6-8,11,20H,3-5,9-10H2,1-2H3,(H,18,21)