N-(5-azanyl-2-fluoranyl-phenyl)-3-(4-methylphenyl)sulfanyl-propanamide

Systemtic Name: N-(5-azanyl-2-fluoranyl-phenyl)-3-(4-methylphenyl)sulfanyl-propanamide Openeye Name: N-(5-amino-2-fluoro-phenyl)-3-(p-tolylsulfanyl)propanamide CAS Name: N-(5-amino-2-fluorophenyl)-3-[(4-methylphenyl)thio]propanamide IUPAC Name: N-(5-amino-2-fluorophenyl)-3-(4-methylphenyl)sulfanylpropanamide Traditional Name: N-(5-amino-2-fluoro-phenyl)-3-(p-tolylthio)propionamide Formula: C16H17FN2OS MolecularWeight: 304.382383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCC(=O)NC2=C(C=CC(=C2)N)F

Isomeric SMILES

CC1=CC=C(C=C1)SCCC(=O)NC2=C(C=CC(=C2)N)F

InChI

InChI=1S/C16H17FN2OS/c1-11-2-5-13(6-3-11)21-9-8-16(20)19-15-10-12(18)4-7-14(15)17/h2-7,10H,8-9,18H2,1H3,(H,19,20)