[3-fluoranyl-4-(pyridin-2-ylsulfanylmethyl)phenyl]methanamine

Systemtic Name: [3-fluoranyl-4-(pyridin-2-ylsulfanylmethyl)phenyl]methanamine Openeye Name: [3-fluoro-4-(2-pyridylsulfanylmethyl)phenyl]methanamine CAS Name: [3-fluoro-4-[(2-pyridinylthio)methyl]phenyl]methanamine IUPAC Name: [3-fluoro-4-(pyridin-2-ylsulfanylmethyl)phenyl]methanamine Traditional Name: [3-fluoro-4-[(2-pyridylthio)methyl]benzyl]amine Formula: C13H13FN2S MolecularWeight: 248.319123

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)SCC2=C(C=C(C=C2)CN)F

Isomeric SMILES

C1=CC=NC(=C1)SCC2=C(C=C(C=C2)CN)F

InChI

InChI=1S/C13H13FN2S/c14-12-7-10(8-15)4-5-11(12)9-17-13-3-1-2-6-16-13/h1-7H,8-9,15H2