N-[2-(5-bromanyl-2-chloranyl-phenyl)-1,3-benzoxazol-5-yl]-4-cyano-2-fluoranyl-benzamide

Systemtic Name: N-[2-(5-bromanyl-2-chloranyl-phenyl)-1,3-benzoxazol-5-yl]-4-cyano-2-fluoranyl-benzamide Openeye Name: N-[2-(5-bromo-2-chloro-phenyl)-1,3-benzoxazol-5-yl]-4-cyano-2-fluoro-benzamide CAS Name: N-[2-(5-bromo-2-chlorophenyl)-1,3-benzoxazol-5-yl]-4-cyano-2-fluorobenzamide IUPAC Name: N-[2-(5-bromo-2-chlorophenyl)-1,3-benzoxazol-5-yl]-4-cyano-2-fluorobenzamide Traditional Name: N-[2-(5-bromo-2-chloro-phenyl)-1,3-benzoxazol-5-yl]-4-cyano-2-fluoro-benzamide Formula: C21H10BrClFN3O2 MolecularWeight: 470.678403

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C#N)F)C(=O)NC2=CC3=C(C=C2)OC(=N3)C4=C(C=CC(=C4)Br)Cl

Isomeric SMILES

C1=CC(=C(C=C1C#N)F)C(=O)NC2=CC3=C(C=C2)OC(=N3)C4=C(C=CC(=C4)Br)Cl

InChI

InChI=1S/C21H10BrClFN3O2/c22-12-2-5-16(23)15(8-12)21-27-18-9-13(3-6-19(18)29-21)26-20(28)14-4-1-11(10-25)7-17(14)24/h1-9H,(H,26,28)