1-(5-methylthiophen-2-yl)sulfonyl-N-[3-(2-pyridin-2-ylethynyl)phenyl]piperidine-3-carboxamide

Systemtic Name: 1-(5-methylthiophen-2-yl)sulfonyl-N-[3-(2-pyridin-2-ylethynyl)phenyl]piperidine-3-carboxamide Openeye Name: 1-[(5-methyl-2-thienyl)sulfonyl]-N-[3-[2-(2-pyridyl)ethynyl]phenyl]piperidine-3-carboxamide CAS Name: 1-[(5-methyl-2-thiophenyl)sulfonyl]-N-[3-[2-(2-pyridinyl)ethynyl]phenyl]-3-piperidinecarboxamide IUPAC Name: 1-(5-methylthiophen-2-yl)sulfonyl-N-[3-(2-pyridin-2-ylethynyl)phenyl]piperidine-3-carboxamide Traditional Name: 1-[(5-methyl-2-thienyl)sulfonyl]-N-[3-[2-(2-pyridyl)ethynyl]phenyl]nipecotamide Formula: C24H23N3O3S2 MolecularWeight: 465.58772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CC=CC(=C3)C#CC4=CC=CC=N4

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CC=CC(=C3)C#CC4=CC=CC=N4

InChI

InChI=1S/C24H23N3O3S2/c1-18-10-13-23(31-18)32(29,30)27-15-5-7-20(17-27)24(28)26-22-9-4-6-19(16-22)11-12-21-8-2-3-14-25-21/h2-4,6,8-10,13-14,16,20H,5,7,15,17H2,1H3,(H,26,28)