1-[5-[(4-fluorophenyl)methylamino]-3-phenyl-1,2,4-triazol-1-yl]butan-1-one

Systemtic Name: 1-[5-[(4-fluorophenyl)methylamino]-3-phenyl-1,2,4-triazol-1-yl]butan-1-one Openeye Name: 1-[5-[(4-fluorophenyl)methylamino]-3-phenyl-1,2,4-triazol-1-yl]butan-1-one CAS Name: 1-[5-[(4-fluorophenyl)methylamino]-3-phenyl-1,2,4-triazol-1-yl]-1-butanone IUPAC Name: 1-[5-[(4-fluorophenyl)methylamino]-3-phenyl-1,2,4-triazol-1-yl]butan-1-one Traditional Name: 1-[5-[(4-fluorobenzyl)amino]-3-phenyl-1,2,4-triazol-1-yl]butan-1-one Formula: C19H19FN4O MolecularWeight: 338.378763

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1C(=NC(=N1)C2=CC=CC=C2)NCC3=CC=C(C=C3)F

Isomeric SMILES

CCCC(=O)N1C(=NC(=N1)C2=CC=CC=C2)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C19H19FN4O/c1-2-6-17(25)24-19(21-13-14-9-11-16(20)12-10-14)22-18(23-24)15-7-4-3-5-8-15/h3-5,7-12H,2,6,13H2,1H3,(H,21,22,23)