5-(4-azanyl-2-fluoranyl-phenyl)sulfanylpentanenitrile

Systemtic Name: 5-(4-azanyl-2-fluoranyl-phenyl)sulfanylpentanenitrile Openeye Name: 5-(4-amino-2-fluoro-phenyl)sulfanylpentanenitrile CAS Name: 5-[(4-amino-2-fluorophenyl)thio]pentanenitrile IUPAC Name: 5-(4-amino-2-fluorophenyl)sulfanylpentanenitrile Traditional Name: 5-[(4-amino-2-fluoro-phenyl)thio]valeronitrile Formula: C11H13FN2S MolecularWeight: 224.297723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N)F)SCCCCC#N

Isomeric SMILES

C1=CC(=C(C=C1N)F)SCCCCC#N

InChI

InChI=1S/C11H13FN2S/c12-10-8-9(14)4-5-11(10)15-7-3-1-2-6-13/h4-5,8H,1-3,7,14H2