4-cyano-2-fluoranyl-N-[6-methyl-2-(4-methylphenyl)benzotriazol-5-yl]benzamide

Systemtic Name: 4-cyano-2-fluoranyl-N-[6-methyl-2-(4-methylphenyl)benzotriazol-5-yl]benzamide Openeye Name: 4-cyano-2-fluoro-N-[6-methyl-2-(p-tolyl)benzotriazol-5-yl]benzamide CAS Name: 4-cyano-2-fluoro-N-[6-methyl-2-(4-methylphenyl)-5-benzotriazolyl]benzamide IUPAC Name: 4-cyano-2-fluoro-N-[6-methyl-2-(4-methylphenyl)benzotriazol-5-yl]benzamide Traditional Name: 4-cyano-2-fluoro-N-[6-methyl-2-(p-tolyl)benzotriazol-5-yl]benzamide Formula: C22H16FN5O MolecularWeight: 385.393743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)NC(=O)C4=C(C=C(C=C4)C#N)F)C

Isomeric SMILES

CC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)NC(=O)C4=C(C=C(C=C4)C#N)F)C

InChI

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