3-butyl-N-[5-(diethylsulfamoyl)-2-morpholin-4-yl-phenyl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-butyl-N-[5-(diethylsulfamoyl)-2-morpholin-4-yl-phenyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-butyl-N-[5-(diethylsulfamoyl)-2-morpholino-phenyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-butyl-N-[5-(diethylsulfamoyl)-2-(4-morpholinyl)phenyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-butyl-N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-butyl-N-[5-(diethylsulfamoyl)-2-morpholino-phenyl]-4-keto-phthalazine-1-carboxamide Formula: C27H35N5O5S MolecularWeight: 541.6623

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CC(=C3)S(=O)(=O)N(CC)CC)N4CCOCC4

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CC(=C3)S(=O)(=O)N(CC)CC)N4CCOCC4

InChI

InChI=1S/C27H35N5O5S/c1-4-7-14-32-27(34)22-11-9-8-10-21(22)25(29-32)26(33)28-23-19-20(38(35,36)31(5-2)6-3)12-13-24(23)30-15-17-37-18-16-30/h8-13,19H,4-7,14-18H2,1-3H3,(H,28,33)