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

Systemtic Name: N-[4-[3-ethoxy-5-(3-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]naphthalene-1-carboxamide Openeye Name: N-[4-[3-ethoxy-5-(3-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]naphthalene-1-carboxamide CAS Name: N-[4-[3-ethoxy-5-(3-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]-1-naphthalenecarboxamide IUPAC Name: N-[4-[3-ethoxy-5-(3-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]naphthalene-1-carboxamide Traditional Name: N-[4-[3-ethoxy-5-(3-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]-1-naphthamide Formula: C27H21FN4O2 MolecularWeight: 452.479643

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NN(C(=N1)C2=CC(=CC=C2)F)C3=CC=C(C=C3)NC(=O)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

CCOC1=NN(C(=N1)C2=CC(=CC=C2)F)C3=CC=C(C=C3)NC(=O)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C27H21FN4O2/c1-2-34-27-30-25(19-9-5-10-20(28)17-19)32(31-27)22-15-13-21(14-16-22)29-26(33)24-12-6-8-18-7-3-4-11-23(18)24/h3-17H,2H2,1H3,(H,29,33)