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

Systemtic Name: 3-(1,3-benzoxazol-2-ylsulfanyl)-N-(4-bromanyl-2-fluoranyl-phenyl)propanamide Openeye Name: 3-(1,3-benzoxazol-2-ylsulfanyl)-N-(4-bromo-2-fluoro-phenyl)propanamide CAS Name: 3-(1,3-benzoxazol-2-ylthio)-N-(4-bromo-2-fluorophenyl)propanamide IUPAC Name: 3-(1,3-benzoxazol-2-ylsulfanyl)-N-(4-bromo-2-fluorophenyl)propanamide Traditional Name: 3-(1,3-benzoxazol-2-ylthio)-N-(4-bromo-2-fluoro-phenyl)propionamide Formula: C16H12BrFN2O2S MolecularWeight: 395.246083

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12BrFN2O2S/c17-10-5-6-12(11(18)9-10)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)