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

Systemtic Name: N-[4-[3-ethoxy-5-(2-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]pentanamide Openeye Name: N-[4-[3-ethoxy-5-(2-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]pentanamide CAS Name: N-[4-[3-ethoxy-5-(2-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]pentanamide IUPAC Name: N-[4-[3-ethoxy-5-(2-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]pentanamide Traditional Name: N-[4-[3-ethoxy-5-(2-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]valeramide Formula: C21H23FN4O2 MolecularWeight: 382.431323

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23FN4O2/c1-3-5-10-19(27)23-15-11-13-16(14-12-15)26-20(24-21(25-26)28-4-2)17-8-6-7-9-18(17)22/h6-9,11-14H,3-5,10H2,1-2H3,(H,23,27)