4-(cyclohexylmethyl)-3-[(4-fluoranylphenoxy)methyl]-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(cyclohexylmethyl)-3-[(4-fluoranylphenoxy)methyl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-(cyclohexylmethyl)-3-[(4-fluorophenoxy)methyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-(cyclohexylmethyl)-3-[(4-fluorophenoxy)methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(cyclohexylmethyl)-3-[(4-fluorophenoxy)methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-(cyclohexylmethyl)-3-[(4-fluorophenoxy)methyl]-1H-1,2,4-triazole-5-thione Formula: C16H20FN3OS MolecularWeight: 321.412903

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN2C(=NNC2=S)COC3=CC=C(C=C3)F

Isomeric SMILES

C1CCC(CC1)CN2C(=NNC2=S)COC3=CC=C(C=C3)F

InChI

InChI=1S/C16H20FN3OS/c17-13-6-8-14(9-7-13)21-11-15-18-19-16(22)20(15)10-12-4-2-1-3-5-12/h6-9,12H,1-5,10-11H2,(H,19,22)