1-[1-(4-chloranyl-2-fluoranyl-phenyl)-5-methyl-1,2,3-triazol-4-yl]-N-ethyl-ethanamine

Systemtic Name: 1-[1-(4-chloranyl-2-fluoranyl-phenyl)-5-methyl-1,2,3-triazol-4-yl]-N-ethyl-ethanamine Openeye Name: 1-[1-(4-chloro-2-fluoro-phenyl)-5-methyl-triazol-4-yl]-N-ethyl-ethanamine CAS Name: 1-[1-(4-chloro-2-fluorophenyl)-5-methyl-4-triazolyl]-N-ethylethanamine IUPAC Name: 1-[1-(4-chloro-2-fluorophenyl)-5-methyltriazol-4-yl]-N-ethylethanamine Traditional Name: 1-[1-(4-chloro-2-fluoro-phenyl)-5-methyl-triazol-4-yl]ethyl-ethyl-amine Formula: C13H16ClFN4 MolecularWeight: 282.744343

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(C)C1=C(N(N=N1)C2=C(C=C(C=C2)Cl)F)C

Isomeric SMILES

CCNC(C)C1=C(N(N=N1)C2=C(C=C(C=C2)Cl)F)C

InChI

InChI=1S/C13H16ClFN4/c1-4-16-8(2)13-9(3)19(18-17-13)12-6-5-10(14)7-11(12)15/h5-8,16H,4H2,1-3H3