4-oxidanylidene-3-propyl-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-3-propyl-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]phthalazine-1-carboxamide Openeye Name: 4-oxo-3-propyl-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]phthalazine-1-carboxamide CAS Name: 4-oxo-3-propyl-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]-1-phthalazinecarboxamide IUPAC Name: 4-oxo-3-propyl-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]phthalazine-1-carboxamide Traditional Name: 4-keto-3-propyl-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]phthalazine-1-carboxamide Formula: C24H27N5O4S MolecularWeight: 481.56728

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC(=CC=C3)S(=O)(=O)NC4=NCCCCC4

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC(=CC=C3)S(=O)(=O)NC4=NCCCCC4

InChI

InChI=1S/C24H27N5O4S/c1-2-15-29-24(31)20-12-6-5-11-19(20)22(27-29)23(30)26-17-9-8-10-18(16-17)34(32,33)28-21-13-4-3-7-14-25-21/h5-6,8-12,16H,2-4,7,13-15H2,1H3,(H,25,28)(H,26,30)