N-[4-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide

Systemtic Name: N-[4-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-[4-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-[4-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-[4-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: 4-keto-3-propyl-N-[4-(1-pyrrolin-2-ylsulfamoyl)phenyl]phthalazine-1-carboxamide Formula: C22H23N5O4S MolecularWeight: 453.51412

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=C(C=C3)S(=O)(=O)NC4=NCCC4

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=C(C=C3)S(=O)(=O)NC4=NCCC4

InChI

InChI=1S/C22H23N5O4S/c1-2-14-27-22(29)18-7-4-3-6-17(18)20(25-27)21(28)24-15-9-11-16(12-10-15)32(30,31)26-19-8-5-13-23-19/h3-4,6-7,9-12H,2,5,8,13-14H2,1H3,(H,23,26)(H,24,28)