2-(1,3-benzoxazol-2-ylsulfanyl)-N-[(E)-(3-bromanyl-4-fluoranyl-phenyl)methylideneamino]ethanamide

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[(E)-(3-bromanyl-4-fluoranyl-phenyl)methylideneamino]ethanamide Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[(E)-(3-bromo-4-fluoro-phenyl)methyleneamino]acetamide CAS Name: 2-(1,3-benzoxazol-2-ylthio)-N-[(E)-(3-bromo-4-fluorophenyl)methylideneamino]acetamide IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[(E)-(3-bromo-4-fluorophenyl)methylideneamino]acetamide Traditional Name: 2-(1,3-benzoxazol-2-ylthio)-N-[(E)-(3-bromo-4-fluoro-benzylidene)amino]acetamide Formula: C16H11BrFN3O2S MolecularWeight: 408.244843

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)SCC(=O)NN=CC3=CC(=C(C=C3)F)Br

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)SCC(=O)N/N=C/C3=CC(=C(C=C3)F)Br

InChI

InChI=1S/C16H11BrFN3O2S/c17-11-7-10(5-6-12(11)18)8-19-21-15(22)9-24-16-20-13-3-1-2-4-14(13)23-16/h1-8H,9H2,(H,21,22)/b19-8+