8-methoxy-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]quinoline-5-sulfonamide

Systemtic Name: 8-methoxy-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]quinoline-5-sulfonamide Openeye Name: 8-methoxy-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]quinoline-5-sulfonamide CAS Name: 8-methoxy-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]-5-quinolinesulfonamide IUPAC Name: 8-methoxy-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]quinoline-5-sulfonamide Traditional Name: 8-methoxy-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]quinoline-5-sulfonamide Formula: C22H24N4O5S2 MolecularWeight: 488.57976

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)S(=O)(=O)NC3=CC=C(C=C3)S(=O)(=O)NC4=NCCCCC4)C=CC=N2

Isomeric SMILES

COC1=C2C(=C(C=C1)S(=O)(=O)NC3=CC=C(C=C3)S(=O)(=O)NC4=NCCCCC4)C=CC=N2

InChI

InChI=1S/C22H24N4O5S2/c1-31-19-12-13-20(18-6-5-15-24-22(18)19)33(29,30)25-16-8-10-17(11-9-16)32(27,28)26-21-7-3-2-4-14-23-21/h5-6,8-13,15,25H,2-4,7,14H2,1H3,(H,23,26)