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

Systemtic Name: 4-oxidanylidene-N'-(3-pyrrolidin-1-ylsulfonylphenyl)carbonyl-3H-phthalazine-1-carbohydrazide Openeye Name: 4-oxo-N'-(3-pyrrolidin-1-ylsulfonylbenzoyl)-3H-phthalazine-1-carbohydrazide CAS Name: 4-oxo-N'-[oxo-[3-(1-pyrrolidinylsulfonyl)phenyl]methyl]-3H-phthalazine-1-carbohydrazide IUPAC Name: 4-oxo-N'-(3-pyrrolidin-1-ylsulfonylbenzoyl)-3H-phthalazine-1-carbohydrazide Traditional Name: 4-keto-N'-(3-pyrrolidinosulfonylbenzoyl)-3H-phthalazine-1-carbohydrazide Formula: C20H19N5O5S MolecularWeight: 441.46036

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=O)C3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=O)C3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C20H19N5O5S/c26-18(13-6-5-7-14(12-13)31(29,30)25-10-3-4-11-25)22-24-20(28)17-15-8-1-2-9-16(15)19(27)23-21-17/h1-2,5-9,12H,3-4,10-11H2,(H,22,26)(H,23,27)(H,24,28)