3-ethyl-4-oxidanylidene-N'-(3-pyrrolidin-1-ylsulfonylphenyl)carbonyl-phthalazine-1-carbohydrazide

Systemtic Name: 3-ethyl-4-oxidanylidene-N'-(3-pyrrolidin-1-ylsulfonylphenyl)carbonyl-phthalazine-1-carbohydrazide Openeye Name: 3-ethyl-4-oxo-N'-(3-pyrrolidin-1-ylsulfonylbenzoyl)phthalazine-1-carbohydrazide CAS Name: 3-ethyl-4-oxo-N'-[oxo-[3-(1-pyrrolidinylsulfonyl)phenyl]methyl]-1-phthalazinecarbohydrazide IUPAC Name: 3-ethyl-4-oxo-N'-(3-pyrrolidin-1-ylsulfonylbenzoyl)phthalazine-1-carbohydrazide Traditional Name: 3-ethyl-4-keto-N'-(3-pyrrolidinosulfonylbenzoyl)phthalazine-1-carbohydrazide Formula: C22H23N5O5S MolecularWeight: 469.51352

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C22H23N5O5S/c1-2-27-22(30)18-11-4-3-10-17(18)19(25-27)21(29)24-23-20(28)15-8-7-9-16(14-15)33(31,32)26-12-5-6-13-26/h3-4,7-11,14H,2,5-6,12-13H2,1H3,(H,23,28)(H,24,29)