4-hexyl-3-[[(4-methoxyphenyl)amino]methyl]-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-hexyl-3-[[(4-methoxyphenyl)amino]methyl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-hexyl-3-[(4-methoxyanilino)methyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-hexyl-3-[(4-methoxyanilino)methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-hexyl-3-[(4-methoxyanilino)methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-hexyl-3-(p-anisidinomethyl)-1H-1,2,4-triazole-5-thione Formula: C16H24N4OS MolecularWeight: 320.45296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=NNC1=S)CNC2=CC=C(C=C2)OC

Isomeric SMILES

CCCCCCN1C(=NNC1=S)CNC2=CC=C(C=C2)OC

InChI

InChI=1S/C16H24N4OS/c1-3-4-5-6-11-20-15(18-19-16(20)22)12-17-13-7-9-14(21-2)10-8-13/h7-10,17H,3-6,11-12H2,1-2H3,(H,19,22)