N3-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-1-phenyl-1,2,4-triazole-3,5-diamine

Systemtic Name: N3-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-1-phenyl-1,2,4-triazole-3,5-diamine Openeye Name: N3-[(2-chloro-6-fluoro-phenyl)methyl]-1-phenyl-1,2,4-triazole-3,5-diamine CAS Name: N3-[(2-chloro-6-fluorophenyl)methyl]-1-phenyl-1,2,4-triazole-3,5-diamine IUPAC Name: 3-N-[(2-chloro-6-fluorophenyl)methyl]-1-phenyl-1,2,4-triazole-3,5-diamine Traditional Name: (5-amino-1-phenyl-1,2,4-triazol-3-yl)-(2-chloro-6-fluoro-benzyl)amine Formula: C15H13ClFN5 MolecularWeight: 317.748623

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NC(=N2)NCC3=C(C=CC=C3Cl)F)N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NC(=N2)NCC3=C(C=CC=C3Cl)F)N

InChI

InChI=1S/C15H13ClFN5/c16-12-7-4-8-13(17)11(12)9-19-15-20-14(18)22(21-15)10-5-2-1-3-6-10/h1-8H,9H2,(H3,18,19,20,21)