2-piperidin-1-ylsulfonyl-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzamide

Systemtic Name: 2-piperidin-1-ylsulfonyl-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzamide Openeye Name: 2-(1-piperidylsulfonyl)-N-[3-[2-(2-thienyl)ethynyl]phenyl]benzamide CAS Name: 2-(1-piperidinylsulfonyl)-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzamide IUPAC Name: 2-piperidin-1-ylsulfonyl-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzamide Traditional Name: 2-piperidinosulfonyl-N-[3-[2-(2-thienyl)ethynyl]phenyl]benzamide Formula: C24H22N2O3S2 MolecularWeight: 450.57308

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C(=O)NC3=CC=CC(=C3)C#CC4=CC=CS4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C(=O)NC3=CC=CC(=C3)C#CC4=CC=CS4

InChI

InChI=1S/C24H22N2O3S2/c27-24(25-20-9-6-8-19(18-20)13-14-21-10-7-17-30-21)22-11-2-3-12-23(22)31(28,29)26-15-4-1-5-16-26/h2-3,6-12,17-18H,1,4-5,15-16H2,(H,25,27)