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

Systemtic Name: 4-cyclopropyl-2-[[(4-ethoxyphenyl)methyl-methyl-amino]methyl]-5-(2-fluorophenyl)-1,2,4-triazole-3-thione Openeye Name: 4-cyclopropyl-2-[[(4-ethoxyphenyl)methyl-methyl-amino]methyl]-5-(2-fluorophenyl)-1,2,4-triazole-3-thione CAS Name: 4-cyclopropyl-2-[[(4-ethoxyphenyl)methyl-methylamino]methyl]-5-(2-fluorophenyl)-1,2,4-triazole-3-thione IUPAC Name: 4-cyclopropyl-2-[[(4-ethoxyphenyl)methyl-methylamino]methyl]-5-(2-fluorophenyl)-1,2,4-triazole-3-thione Traditional Name: 4-cyclopropyl-2-[[(4-ethoxybenzyl)-methyl-amino]methyl]-5-(2-fluorophenyl)-1,2,4-triazole-3-thione Formula: C22H25FN4OS MolecularWeight: 412.523503

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CN(C)CN2C(=S)N(C(=N2)C3=CC=CC=C3F)C4CC4

Isomeric SMILES

CCOC1=CC=C(C=C1)CN(C)CN2C(=S)N(C(=N2)C3=CC=CC=C3F)C4CC4

InChI

InChI=1S/C22H25FN4OS/c1-3-28-18-12-8-16(9-13-18)14-25(2)15-26-22(29)27(17-10-11-17)21(24-26)19-6-4-5-7-20(19)23/h4-9,12-13,17H,3,10-11,14-15H2,1-2H3