N-[4-[3-ethoxy-5-(2-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]hexanamide

Systemtic Name: N-[4-[3-ethoxy-5-(2-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]hexanamide Openeye Name: N-[4-[3-ethoxy-5-(2-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]hexanamide CAS Name: N-[4-[3-ethoxy-5-(2-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]hexanamide IUPAC Name: N-[4-[3-ethoxy-5-(2-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]hexanamide Traditional Name: N-[4-[3-ethoxy-5-(2-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]hexanamide Formula: C22H25FN4O2 MolecularWeight: 396.457903

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC1=CC=C(C=C1)N2C(=NC(=N2)OCC)C3=CC=CC=C3F

Isomeric SMILES

CCCCCC(=O)NC1=CC=C(C=C1)N2C(=NC(=N2)OCC)C3=CC=CC=C3F

InChI

InChI=1S/C22H25FN4O2/c1-3-5-6-11-20(28)24-16-12-14-17(15-13-16)27-21(25-22(26-27)29-4-2)18-9-7-8-10-19(18)23/h7-10,12-15H,3-6,11H2,1-2H3,(H,24,28)