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

Systemtic Name: N-[4-[3-ethoxy-5-(3-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]hexanamide Openeye Name: N-[4-[3-ethoxy-5-(3-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]hexanamide CAS Name: N-[4-[3-ethoxy-5-(3-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]hexanamide IUPAC Name: N-[4-[3-ethoxy-5-(3-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]hexanamide Traditional Name: N-[4-[3-ethoxy-5-(3-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=C3)F

Isomeric SMILES

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

InChI

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