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

Systemtic Name: N-[4-[3-ethoxy-5-(3-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]butanamide Openeye Name: N-[4-[3-ethoxy-5-(3-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]butanamide CAS Name: N-[4-[3-ethoxy-5-(3-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]butanamide IUPAC Name: N-[4-[3-ethoxy-5-(3-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]butanamide Traditional Name: N-[4-[3-ethoxy-5-(3-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]butyramide Formula: C20H21FN4O2 MolecularWeight: 368.404743

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21FN4O2/c1-3-6-18(26)22-16-9-11-17(12-10-16)25-19(23-20(24-25)27-4-2)14-7-5-8-15(21)13-14/h5,7-13H,3-4,6H2,1-2H3,(H,22,26)