2-(3-azanylpyridin-4-yl)sulfanyl-N-[(4-fluoranyl-3-methyl-phenyl)methyl]ethanamide

Systemtic Name: 2-(3-azanylpyridin-4-yl)sulfanyl-N-[(4-fluoranyl-3-methyl-phenyl)methyl]ethanamide Openeye Name: 2-[(3-amino-4-pyridyl)sulfanyl]-N-[(4-fluoro-3-methyl-phenyl)methyl]acetamide CAS Name: 2-[(3-amino-4-pyridinyl)thio]-N-[(4-fluoro-3-methylphenyl)methyl]acetamide IUPAC Name: 2-(3-aminopyridin-4-yl)sulfanyl-N-[(4-fluoro-3-methylphenyl)methyl]acetamide Traditional Name: 2-[(3-amino-4-pyridyl)thio]-N-(4-fluoro-3-methyl-benzyl)acetamide Formula: C15H16FN3OS MolecularWeight: 305.370443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CNC(=O)CSC2=C(C=NC=C2)N)F

Isomeric SMILES

CC1=C(C=CC(=C1)CNC(=O)CSC2=C(C=NC=C2)N)F

InChI

InChI=1S/C15H16FN3OS/c1-10-6-11(2-3-12(10)16)7-19-15(20)9-21-14-4-5-18-8-13(14)17/h2-6,8H,7,9,17H2,1H3,(H,19,20)