4-cyano-N-[2-(4-ethylphenyl)benzotriazol-5-yl]-2-fluoranyl-benzamide

Systemtic Name: 4-cyano-N-[2-(4-ethylphenyl)benzotriazol-5-yl]-2-fluoranyl-benzamide Openeye Name: 4-cyano-N-[2-(4-ethylphenyl)benzotriazol-5-yl]-2-fluoro-benzamide CAS Name: 4-cyano-N-[2-(4-ethylphenyl)-5-benzotriazolyl]-2-fluorobenzamide IUPAC Name: 4-cyano-N-[2-(4-ethylphenyl)benzotriazol-5-yl]-2-fluorobenzamide Traditional Name: 4-cyano-N-[2-(4-ethylphenyl)benzotriazol-5-yl]-2-fluoro-benzamide Formula: C22H16FN5O MolecularWeight: 385.393743

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)C4=C(C=C(C=C4)C#N)F

Isomeric SMILES

CCC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)C4=C(C=C(C=C4)C#N)F

InChI

InChI=1S/C22H16FN5O/c1-2-14-3-7-17(8-4-14)28-26-20-10-6-16(12-21(20)27-28)25-22(29)18-9-5-15(13-24)11-19(18)23/h3-12H,2H2,1H3,(H,25,29)