2-[(3-fluorophenyl)methylamino]pyridine-3-carbothioamide

Systemtic Name: 2-[(3-fluorophenyl)methylamino]pyridine-3-carbothioamide Openeye Name: 2-[(3-fluorophenyl)methylamino]pyridine-3-carbothioamide CAS Name: 2-[(3-fluorophenyl)methylamino]-3-pyridinecarbothioamide IUPAC Name: 2-[(3-fluorophenyl)methylamino]pyridine-3-carbothioamide Traditional Name: 2-[(3-fluorobenzyl)amino]thionicotinamide Formula: C13H12FN3S MolecularWeight: 261.317883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)CNC2=C(C=CC=N2)C(=S)N

Isomeric SMILES

C1=CC(=CC(=C1)F)CNC2=C(C=CC=N2)C(=S)N

InChI

InChI=1S/C13H12FN3S/c14-10-4-1-3-9(7-10)8-17-13-11(12(15)18)5-2-6-16-13/h1-7H,8H2,(H2,15,18)(H,16,17)