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

Systemtic Name: 4-butyl-2-[[(4-fluorophenyl)methyl-methyl-amino]methyl]-5-(4-methoxyphenyl)-1,2,4-triazole-3-thione Openeye Name: 4-butyl-2-[[(4-fluorophenyl)methyl-methyl-amino]methyl]-5-(4-methoxyphenyl)-1,2,4-triazole-3-thione CAS Name: 4-butyl-2-[[(4-fluorophenyl)methyl-methylamino]methyl]-5-(4-methoxyphenyl)-1,2,4-triazole-3-thione IUPAC Name: 4-butyl-2-[[(4-fluorophenyl)methyl-methylamino]methyl]-5-(4-methoxyphenyl)-1,2,4-triazole-3-thione Traditional Name: 4-butyl-2-[[(4-fluorobenzyl)-methyl-amino]methyl]-5-(4-methoxyphenyl)-1,2,4-triazole-3-thione Formula: C22H27FN4OS MolecularWeight: 414.539383

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN(C1=S)CN(C)CC2=CC=C(C=C2)F)C3=CC=C(C=C3)OC

Isomeric SMILES

CCCCN1C(=NN(C1=S)CN(C)CC2=CC=C(C=C2)F)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H27FN4OS/c1-4-5-14-26-21(18-8-12-20(28-3)13-9-18)24-27(22(26)29)16-25(2)15-17-6-10-19(23)11-7-17/h6-13H,4-5,14-16H2,1-3H3