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

Systemtic Name: 4-cyclopropyl-5-(2-fluorophenyl)-2-[[(4-methoxyphenyl)methyl-methyl-amino]methyl]-1,2,4-triazole-3-thione Openeye Name: 4-cyclopropyl-5-(2-fluorophenyl)-2-[[(4-methoxyphenyl)methyl-methyl-amino]methyl]-1,2,4-triazole-3-thione CAS Name: 4-cyclopropyl-5-(2-fluorophenyl)-2-[[(4-methoxyphenyl)methyl-methylamino]methyl]-1,2,4-triazole-3-thione IUPAC Name: 4-cyclopropyl-5-(2-fluorophenyl)-2-[[(4-methoxyphenyl)methyl-methylamino]methyl]-1,2,4-triazole-3-thione Traditional Name: 4-cyclopropyl-5-(2-fluorophenyl)-2-[[methyl(p-anisyl)amino]methyl]-1,2,4-triazole-3-thione Formula: C21H23FN4OS MolecularWeight: 398.496923

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)OC)CN2C(=S)N(C(=N2)C3=CC=CC=C3F)C4CC4

Isomeric SMILES

CN(CC1=CC=C(C=C1)OC)CN2C(=S)N(C(=N2)C3=CC=CC=C3F)C4CC4

InChI

InChI=1S/C21H23FN4OS/c1-24(13-15-7-11-17(27-2)12-8-15)14-25-21(28)26(16-9-10-16)20(23-25)18-5-3-4-6-19(18)22/h3-8,11-12,16H,9-10,13-14H2,1-2H3