1-[6-[3-(2-thiophen-2-ylethynyl)phenyl]hex-5-ynyl]piperidin-2-one

Systemtic Name: 1-[6-[3-(2-thiophen-2-ylethynyl)phenyl]hex-5-ynyl]piperidin-2-one Openeye Name: 1-[6-[3-[2-(2-thienyl)ethynyl]phenyl]hex-5-ynyl]piperidin-2-one CAS Name: 1-[6-[3-(2-thiophen-2-ylethynyl)phenyl]hex-5-ynyl]-2-piperidinone IUPAC Name: 1-[6-[3-(2-thiophen-2-ylethynyl)phenyl]hex-5-ynyl]piperidin-2-one Traditional Name: 1-[6-[3-[2-(2-thienyl)ethynyl]phenyl]hex-5-ynyl]-2-piperidone Formula: C23H23NOS MolecularWeight: 361.49982

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(=O)C1)CCCCC#CC2=CC=CC(=C2)C#CC3=CC=CS3

Isomeric SMILES

C1CCN(C(=O)C1)CCCCC#CC2=CC=CC(=C2)C#CC3=CC=CS3

InChI

InChI=1S/C23H23NOS/c25-23-13-4-6-17-24(23)16-5-2-1-3-9-20-10-7-11-21(19-20)14-15-22-12-8-18-26-22/h7-8,10-12,18-19H,1-2,4-6,13,16-17H2