3-(cyanomethyl)-N'-(4-pyrrolidin-1-ylsulfonylphenyl)carbonyl-benzohydrazide

Systemtic Name: 3-(cyanomethyl)-N'-(4-pyrrolidin-1-ylsulfonylphenyl)carbonyl-benzohydrazide Openeye Name: 3-(cyanomethyl)-N'-(4-pyrrolidin-1-ylsulfonylbenzoyl)benzohydrazide CAS Name: 3-(cyanomethyl)-N'-[oxo-[4-(1-pyrrolidinylsulfonyl)phenyl]methyl]benzohydrazide IUPAC Name: 3-(cyanomethyl)-N'-(4-pyrrolidin-1-ylsulfonylbenzoyl)benzohydrazide Traditional Name: 3-(cyanomethyl)-N'-(4-pyrrolidinosulfonylbenzoyl)benzohydrazide Formula: C20H20N4O4S MolecularWeight: 412.4622

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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(=CC=C3)CC#N

Isomeric SMILES

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

InChI

InChI=1S/C20H20N4O4S/c21-11-10-15-4-3-5-17(14-15)20(26)23-22-19(25)16-6-8-18(9-7-16)29(27,28)24-12-1-2-13-24/h3-9,14H,1-2,10,12-13H2,(H,22,25)(H,23,26)