2-[4-[2-[[phenyl(thiophen-2-yl)methyl]amino]ethanoyl]piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-[2-[[phenyl(thiophen-2-yl)methyl]amino]ethanoyl]piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-[2-[[phenyl(2-thienyl)methyl]amino]acetyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-[1-oxo-2-[[phenyl(thiophen-2-yl)methyl]amino]ethyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-[2-[[phenyl(thiophen-2-yl)methyl]amino]acetyl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-[2-[[phenyl(2-thienyl)methyl]amino]acetyl]piperazino]sulfonylbenzonitrile Formula: C24H24N4O3S2 MolecularWeight: 480.60236

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CNC(C2=CC=CC=C2)C3=CC=CS3)S(=O)(=O)C4=CC=CC=C4C#N

Isomeric SMILES

C1CN(CCN1C(=O)CNC(C2=CC=CC=C2)C3=CC=CS3)S(=O)(=O)C4=CC=CC=C4C#N

InChI

InChI=1S/C24H24N4O3S2/c25-17-20-9-4-5-11-22(20)33(30,31)28-14-12-27(13-15-28)23(29)18-26-24(21-10-6-16-32-21)19-7-2-1-3-8-19/h1-11,16,24,26H,12-15,18H2