N-[2-[(4-methoxyphenyl)sulfonylamino]ethyl]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide

Systemtic Name: N-[2-[(4-methoxyphenyl)sulfonylamino]ethyl]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-[2-[(4-methoxyphenyl)sulfonylamino]ethyl]-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-[2-[(4-methoxyphenyl)sulfonylamino]ethyl]-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-[2-[(4-methoxyphenyl)sulfonylamino]ethyl]-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: 4-keto-N-[2-[(4-methoxyphenyl)sulfonylamino]ethyl]-3-propyl-phthalazine-1-carboxamide Formula: C21H24N4O5S MolecularWeight: 444.50406

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCCNS(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCCNS(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H24N4O5S/c1-3-14-25-21(27)18-7-5-4-6-17(18)19(24-25)20(26)22-12-13-23-31(28,29)16-10-8-15(30-2)9-11-16/h4-11,23H,3,12-14H2,1-2H3,(H,22,26)