3-butyl-N-[3-[methyl(phenyl)sulfamoyl]phenyl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-butyl-N-[3-[methyl(phenyl)sulfamoyl]phenyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-butyl-N-[3-[methyl(phenyl)sulfamoyl]phenyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-butyl-N-[3-[methyl(phenyl)sulfamoyl]phenyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-butyl-N-[3-[methyl(phenyl)sulfamoyl]phenyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-butyl-4-keto-N-[3-[methyl(phenyl)sulfamoyl]phenyl]phthalazine-1-carboxamide Formula: C26H26N4O4S MolecularWeight: 490.57404

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N(C)C4=CC=CC=C4

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N(C)C4=CC=CC=C4

InChI

InChI=1S/C26H26N4O4S/c1-3-4-17-30-26(32)23-16-9-8-15-22(23)24(28-30)25(31)27-19-11-10-14-21(18-19)35(33,34)29(2)20-12-6-5-7-13-20/h5-16,18H,3-4,17H2,1-2H3,(H,27,31)