2-[[(2-chloranyl-6-fluoranyl-phenyl)methyl-methyl-amino]methyl]-4-ethyl-5-morpholin-4-yl-1,2,4-triazole-3-thione

Systemtic Name: 2-[[(2-chloranyl-6-fluoranyl-phenyl)methyl-methyl-amino]methyl]-4-ethyl-5-morpholin-4-yl-1,2,4-triazole-3-thione Openeye Name: 2-[[(2-chloro-6-fluoro-phenyl)methyl-methyl-amino]methyl]-4-ethyl-5-morpholino-1,2,4-triazole-3-thione CAS Name: 2-[[(2-chloro-6-fluorophenyl)methyl-methylamino]methyl]-4-ethyl-5-(4-morpholinyl)-1,2,4-triazole-3-thione IUPAC Name: 2-[[(2-chloro-6-fluorophenyl)methyl-methylamino]methyl]-4-ethyl-5-morpholin-4-yl-1,2,4-triazole-3-thione Traditional Name: 2-[[(2-chloro-6-fluoro-benzyl)-methyl-amino]methyl]-4-ethyl-5-morpholino-1,2,4-triazole-3-thione Formula: C17H23ClFN5OS MolecularWeight: 399.913823

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN(C1=S)CN(C)CC2=C(C=CC=C2Cl)F)N3CCOCC3

Isomeric SMILES

CCN1C(=NN(C1=S)CN(C)CC2=C(C=CC=C2Cl)F)N3CCOCC3

InChI

InChI=1S/C17H23ClFN5OS/c1-3-23-16(22-7-9-25-10-8-22)20-24(17(23)26)12-21(2)11-13-14(18)5-4-6-15(13)19/h4-6H,3,7-12H2,1-2H3