3-phenyl-N'-(4-pyrrolidin-1-ylsulfonylphenyl)carbonyl-1H-pyrazole-5-carbohydrazide

Systemtic Name: 3-phenyl-N'-(4-pyrrolidin-1-ylsulfonylphenyl)carbonyl-1H-pyrazole-5-carbohydrazide Openeye Name: 3-phenyl-N'-(4-pyrrolidin-1-ylsulfonylbenzoyl)-1H-pyrazole-5-carbohydrazide CAS Name: N'-[oxo-[4-(1-pyrrolidinylsulfonyl)phenyl]methyl]-3-phenyl-1H-pyrazole-5-carbohydrazide IUPAC Name: 3-phenyl-N'-(4-pyrrolidin-1-ylsulfonylbenzoyl)-1H-pyrazole-5-carbohydrazide Traditional Name: 3-phenyl-N'-(4-pyrrolidinosulfonylbenzoyl)-1H-pyrazole-5-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=CC(=NN3)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NNC(=O)C3=CC(=NN3)C4=CC=CC=C4

InChI

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