2-ethynyl-N-(5-fluoranyl-2-piperidin-1-yl-phenyl)pyridine-4-carbothioamide

Systemtic Name: 2-ethynyl-N-(5-fluoranyl-2-piperidin-1-yl-phenyl)pyridine-4-carbothioamide Openeye Name: 2-ethynyl-N-[5-fluoro-2-(1-piperidyl)phenyl]pyridine-4-carbothioamide CAS Name: 2-ethynyl-N-[5-fluoro-2-(1-piperidinyl)phenyl]-4-pyridinecarbothioamide IUPAC Name: 2-ethynyl-N-(5-fluoro-2-piperidin-1-ylphenyl)pyridine-4-carbothioamide Traditional Name: 2-ethynyl-N-(5-fluoro-2-piperidino-phenyl)thioisonicotinamide Formula: C19H18FN3S MolecularWeight: 339.429723

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=NC=CC(=C1)C(=S)NC2=C(C=CC(=C2)F)N3CCCCC3

Isomeric SMILES

C#CC1=NC=CC(=C1)C(=S)NC2=C(C=CC(=C2)F)N3CCCCC3

InChI

InChI=1S/C19H18FN3S/c1-2-16-12-14(8-9-21-16)19(24)22-17-13-15(20)6-7-18(17)23-10-4-3-5-11-23/h1,6-9,12-13H,3-5,10-11H2,(H,22,24)