N-[4-[3-ethoxy-5-(4-methylphenyl)-1,2,4-triazol-1-yl]phenyl]-3-fluoranyl-benzamide

Systemtic Name: N-[4-[3-ethoxy-5-(4-methylphenyl)-1,2,4-triazol-1-yl]phenyl]-3-fluoranyl-benzamide Openeye Name: N-[4-[3-ethoxy-5-(p-tolyl)-1,2,4-triazol-1-yl]phenyl]-3-fluoro-benzamide CAS Name: N-[4-[3-ethoxy-5-(4-methylphenyl)-1,2,4-triazol-1-yl]phenyl]-3-fluorobenzamide IUPAC Name: N-[4-[3-ethoxy-5-(4-methylphenyl)-1,2,4-triazol-1-yl]phenyl]-3-fluorobenzamide Traditional Name: N-[4-[3-ethoxy-5-(p-tolyl)-1,2,4-triazol-1-yl]phenyl]-3-fluoro-benzamide Formula: C24H21FN4O2 MolecularWeight: 416.447543

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NN(C(=N1)C2=CC=C(C=C2)C)C3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)F

Isomeric SMILES

CCOC1=NN(C(=N1)C2=CC=C(C=C2)C)C3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)F

InChI

InChI=1S/C24H21FN4O2/c1-3-31-24-27-22(17-9-7-16(2)8-10-17)29(28-24)21-13-11-20(12-14-21)26-23(30)18-5-4-6-19(25)15-18/h4-15H,3H2,1-2H3,(H,26,30)