2-[(3-fluorophenyl)methylsulfanyl]-N-heptyl-pyridine-3-carboxamide

Systemtic Name: 2-[(3-fluorophenyl)methylsulfanyl]-N-heptyl-pyridine-3-carboxamide Openeye Name: 2-[(3-fluorophenyl)methylsulfanyl]-N-heptyl-pyridine-3-carboxamide CAS Name: 2-[(3-fluorophenyl)methylthio]-N-heptyl-3-pyridinecarboxamide IUPAC Name: 2-[(3-fluorophenyl)methylsulfanyl]-N-heptylpyridine-3-carboxamide Traditional Name: 2-[(3-fluorobenzyl)thio]-N-heptyl-nicotinamide Formula: C20H25FN2OS MolecularWeight: 360.488703

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC(=O)C1=C(N=CC=C1)SCC2=CC(=CC=C2)F

Isomeric SMILES

CCCCCCCNC(=O)C1=C(N=CC=C1)SCC2=CC(=CC=C2)F

InChI

InChI=1S/C20H25FN2OS/c1-2-3-4-5-6-12-22-19(24)18-11-8-13-23-20(18)25-15-16-9-7-10-17(21)14-16/h7-11,13-14H,2-6,12,15H2,1H3,(H,22,24)