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

Systemtic Name: 2-butan-2-yl-4-[(2-fluorophenyl)methylamino]-1,2,4-triazol-3-one Openeye Name: 4-[(2-fluorophenyl)methylamino]-2-sec-butyl-1,2,4-triazol-3-one CAS Name: 2-butan-2-yl-4-[(2-fluorophenyl)methylamino]-1,2,4-triazol-3-one IUPAC Name: 2-butan-2-yl-4-[(2-fluorophenyl)methylamino]-1,2,4-triazol-3-one Traditional Name: 4-[(2-fluorobenzyl)amino]-2-sec-butyl-1,2,4-triazol-3-one Formula: C13H17FN4O MolecularWeight: 264.298683

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)N(C=N1)NCC2=CC=CC=C2F

Isomeric SMILES

CCC(C)N1C(=O)N(C=N1)NCC2=CC=CC=C2F

InChI

InChI=1S/C13H17FN4O/c1-3-10(2)18-13(19)17(9-16-18)15-8-11-6-4-5-7-12(11)14/h4-7,9-10,15H,3,8H2,1-2H3