2-chloranyl-5-piperidin-1-ylsulfonyl-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzamide

Systemtic Name: 2-chloranyl-5-piperidin-1-ylsulfonyl-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzamide Openeye Name: 2-chloro-5-(1-piperidylsulfonyl)-N-[3-[2-(2-thienyl)ethynyl]phenyl]benzamide CAS Name: 2-chloro-5-(1-piperidinylsulfonyl)-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzamide IUPAC Name: 2-chloro-5-piperidin-1-ylsulfonyl-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzamide Traditional Name: 2-chloro-5-piperidinosulfonyl-N-[3-[2-(2-thienyl)ethynyl]phenyl]benzamide Formula: C24H21ClN2O3S2 MolecularWeight: 485.01814

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H21ClN2O3S2/c25-23-12-11-21(32(29,30)27-13-2-1-3-14-27)17-22(23)24(28)26-19-7-4-6-18(16-19)9-10-20-8-5-15-31-20/h4-8,11-12,15-17H,1-3,13-14H2,(H,26,28)