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

Systemtic Name: N-[5-(5-butan-2-yl-1,3-benzoxazol-2-yl)-2-chloranyl-phenyl]-4-cyano-2-fluoranyl-benzamide Openeye Name: N-[2-chloro-5-(5-sec-butyl-1,3-benzoxazol-2-yl)phenyl]-4-cyano-2-fluoro-benzamide CAS Name: N-[5-(5-butan-2-yl-1,3-benzoxazol-2-yl)-2-chlorophenyl]-4-cyano-2-fluorobenzamide IUPAC Name: N-[5-(5-butan-2-yl-1,3-benzoxazol-2-yl)-2-chlorophenyl]-4-cyano-2-fluorobenzamide Traditional Name: N-[2-chloro-5-(5-sec-butyl-1,3-benzoxazol-2-yl)phenyl]-4-cyano-2-fluoro-benzamide Formula: C25H19ClFN3O2 MolecularWeight: 447.888663

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC2=C(C=C1)OC(=N2)C3=CC(=C(C=C3)Cl)NC(=O)C4=C(C=C(C=C4)C#N)F

Isomeric SMILES

CCC(C)C1=CC2=C(C=C1)OC(=N2)C3=CC(=C(C=C3)Cl)NC(=O)C4=C(C=C(C=C4)C#N)F

InChI

InChI=1S/C25H19ClFN3O2/c1-3-14(2)16-6-9-23-22(11-16)30-25(32-23)17-5-8-19(26)21(12-17)29-24(31)18-7-4-15(13-28)10-20(18)27/h4-12,14H,3H2,1-2H3,(H,29,31)