3-(1,3-benzoxazol-2-ylsulfanyl)-N-(3-chloranyl-4-fluoranyl-phenyl)propanamide

Systemtic Name: 3-(1,3-benzoxazol-2-ylsulfanyl)-N-(3-chloranyl-4-fluoranyl-phenyl)propanamide Openeye Name: 3-(1,3-benzoxazol-2-ylsulfanyl)-N-(3-chloro-4-fluoro-phenyl)propanamide CAS Name: 3-(1,3-benzoxazol-2-ylthio)-N-(3-chloro-4-fluorophenyl)propanamide IUPAC Name: 3-(1,3-benzoxazol-2-ylsulfanyl)-N-(3-chloro-4-fluorophenyl)propanamide Traditional Name: 3-(1,3-benzoxazol-2-ylthio)-N-(3-chloro-4-fluoro-phenyl)propionamide Formula: C16H12ClFN2O2S MolecularWeight: 350.795083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)SCCC(=O)NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)SCCC(=O)NC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C16H12ClFN2O2S/c17-11-9-10(5-6-12(11)18)19-15(21)7-8-23-16-20-13-3-1-2-4-14(13)22-16/h1-6,9H,7-8H2,(H,19,21)