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

Systemtic Name: 4-oxidanylidene-N'-(4-pyrrolidin-1-ylsulfonylphenyl)carbonyl-1H-quinoline-3-carbohydrazide Openeye Name: 4-oxo-N'-(4-pyrrolidin-1-ylsulfonylbenzoyl)-1H-quinoline-3-carbohydrazide CAS Name: 4-oxo-N'-[oxo-[4-(1-pyrrolidinylsulfonyl)phenyl]methyl]-1H-quinoline-3-carbohydrazide IUPAC Name: 4-oxo-N'-(4-pyrrolidin-1-ylsulfonylbenzoyl)-1H-quinoline-3-carbohydrazide Traditional Name: 4-keto-N'-(4-pyrrolidinosulfonylbenzoyl)-1H-quinoline-3-carbohydrazide Formula: C21H20N4O5S MolecularWeight: 440.4723

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NNC(=O)C3=CNC4=CC=CC=C4C3=O

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NNC(=O)C3=CNC4=CC=CC=C4C3=O

InChI

InChI=1S/C21H20N4O5S/c26-19-16-5-1-2-6-18(16)22-13-17(19)21(28)24-23-20(27)14-7-9-15(10-8-14)31(29,30)25-11-3-4-12-25/h1-2,5-10,13H,3-4,11-12H2,(H,22,26)(H,23,27)(H,24,28)