N-(3-azanyl-4-fluoranyl-phenyl)-2-(phenylmethylsulfanyl)propanamide

Systemtic Name: N-(3-azanyl-4-fluoranyl-phenyl)-2-(phenylmethylsulfanyl)propanamide Openeye Name: N-(3-amino-4-fluoro-phenyl)-2-benzylsulfanyl-propanamide CAS Name: N-(3-amino-4-fluorophenyl)-2-(phenylmethylthio)propanamide IUPAC Name: N-(3-amino-4-fluorophenyl)-2-benzylsulfanylpropanamide Traditional Name: N-(3-amino-4-fluoro-phenyl)-2-(benzylthio)propionamide Formula: C16H17FN2OS MolecularWeight: 304.382383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=C(C=C1)F)N)SCC2=CC=CC=C2

Isomeric SMILES

CC(C(=O)NC1=CC(=C(C=C1)F)N)SCC2=CC=CC=C2

InChI

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