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

Systemtic Name: 2,5-dimethyl-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]thiophene-3-sulfonamide Openeye Name: 2,5-dimethyl-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]thiophene-3-sulfonamide CAS Name: 2,5-dimethyl-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]-3-thiophenesulfonamide IUPAC Name: 2,5-dimethyl-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]thiophene-3-sulfonamide Traditional Name: 2,5-dimethyl-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]thiophene-3-sulfonamide Formula: C18H23N3O4S3 MolecularWeight: 441.58792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)S(=O)(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NCCCCC3

Isomeric SMILES

CC1=CC(=C(S1)C)S(=O)(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NCCCCC3

InChI

InChI=1S/C18H23N3O4S3/c1-13-12-17(14(2)26-13)28(24,25)20-15-7-9-16(10-8-15)27(22,23)21-18-6-4-3-5-11-19-18/h7-10,12,20H,3-6,11H2,1-2H3,(H,19,21)