1-phenyl-N'-(4-pyrrolidin-1-ylsulfonylphenyl)carbonyl-pyrazole-4-carbohydrazide

Systemtic Name: 1-phenyl-N'-(4-pyrrolidin-1-ylsulfonylphenyl)carbonyl-pyrazole-4-carbohydrazide Openeye Name: 1-phenyl-N'-(4-pyrrolidin-1-ylsulfonylbenzoyl)pyrazole-4-carbohydrazide CAS Name: N'-[oxo-[4-(1-pyrrolidinylsulfonyl)phenyl]methyl]-1-phenyl-4-pyrazolecarbohydrazide IUPAC Name: 1-phenyl-N'-(4-pyrrolidin-1-ylsulfonylbenzoyl)pyrazole-4-carbohydrazide Traditional Name: 1-phenyl-N'-(4-pyrrolidinosulfonylbenzoyl)pyrazole-4-carbohydrazide Formula: C21H21N5O4S MolecularWeight: 439.48754

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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=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C21H21N5O4S/c27-20(16-8-10-19(11-9-16)31(29,30)25-12-4-5-13-25)23-24-21(28)17-14-22-26(15-17)18-6-2-1-3-7-18/h1-3,6-11,14-15H,4-5,12-13H2,(H,23,27)(H,24,28)