3-bromanyl-5-ethoxy-4-methoxy-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]benzamide

Systemtic Name: 3-bromanyl-5-ethoxy-4-methoxy-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]benzamide Openeye Name: 3-bromo-5-ethoxy-4-methoxy-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]benzamide CAS Name: 3-bromo-5-ethoxy-4-methoxy-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]benzamide IUPAC Name: 3-bromo-5-ethoxy-4-methoxy-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]benzamide Traditional Name: 3-bromo-5-ethoxy-4-methoxy-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]benzamide Formula: C22H26BrN3O5S MolecularWeight: 524.42794

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NCCCCC3)Br)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NCCCCC3)Br)OC

InChI

InChI=1S/C22H26BrN3O5S/c1-3-31-19-14-15(13-18(23)21(19)30-2)22(27)25-16-8-10-17(11-9-16)32(28,29)26-20-7-5-4-6-12-24-20/h8-11,13-14H,3-7,12H2,1-2H3,(H,24,26)(H,25,27)