4-[4-[3-[(2-oxidanylidenepyrrolidin-1-yl)methyl]phenyl]carbonylpiperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 4-[4-[3-[(2-oxidanylidenepyrrolidin-1-yl)methyl]phenyl]carbonylpiperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 4-[4-[3-[(2-oxopyrrolidin-1-yl)methyl]benzoyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 4-[[4-[oxo-[3-[(2-oxo-1-pyrrolidinyl)methyl]phenyl]methyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 4-[4-[3-[(2-oxopyrrolidin-1-yl)methyl]benzoyl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 4-[4-[3-[(2-ketopyrrolidino)methyl]benzoyl]piperazino]sulfonylbenzonitrile Formula: C23H24N4O4S MolecularWeight: 452.52606

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CC2=CC=CC(=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1CC(=O)N(C1)CC2=CC=CC(=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C23H24N4O4S/c24-16-18-6-8-21(9-7-18)32(30,31)27-13-11-25(12-14-27)23(29)20-4-1-3-19(15-20)17-26-10-2-5-22(26)28/h1,3-4,6-9,15H,2,5,10-14,17H2