3-[(6-azanylpyridin-3-yl)sulfanylmethyl]-4-fluoranyl-benzenecarbonitrile

Systemtic Name: 3-[(6-azanylpyridin-3-yl)sulfanylmethyl]-4-fluoranyl-benzenecarbonitrile Openeye Name: 3-[(6-amino-3-pyridyl)sulfanylmethyl]-4-fluoro-benzonitrile CAS Name: 3-[[(6-amino-3-pyridinyl)thio]methyl]-4-fluorobenzonitrile IUPAC Name: 3-[(6-aminopyridin-3-yl)sulfanylmethyl]-4-fluorobenzonitrile Traditional Name: 3-[[(6-amino-3-pyridyl)thio]methyl]-4-fluoro-benzonitrile Formula: C13H10FN3S MolecularWeight: 259.302003

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C#N)CSC2=CN=C(C=C2)N)F

Isomeric SMILES

C1=CC(=C(C=C1C#N)CSC2=CN=C(C=C2)N)F

InChI

InChI=1S/C13H10FN3S/c14-12-3-1-9(6-15)5-10(12)8-18-11-2-4-13(16)17-7-11/h1-5,7H,8H2,(H2,16,17)