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

Systemtic Name: 2-[[(4-bromophenyl)methyl-methyl-amino]methyl]-5-(2-fluorophenyl)-4-methyl-1,2,4-triazole-3-thione Openeye Name: 2-[[(4-bromophenyl)methyl-methyl-amino]methyl]-5-(2-fluorophenyl)-4-methyl-1,2,4-triazole-3-thione CAS Name: 2-[[(4-bromophenyl)methyl-methylamino]methyl]-5-(2-fluorophenyl)-4-methyl-1,2,4-triazole-3-thione IUPAC Name: 2-[[(4-bromophenyl)methyl-methylamino]methyl]-5-(2-fluorophenyl)-4-methyl-1,2,4-triazole-3-thione Traditional Name: 2-[[(4-bromobenzyl)-methyl-amino]methyl]-5-(2-fluorophenyl)-4-methyl-1,2,4-triazole-3-thione Formula: C18H18BrFN4S MolecularWeight: 421.329723

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=S)CN(C)CC2=CC=C(C=C2)Br)C3=CC=CC=C3F

Isomeric SMILES

CN1C(=NN(C1=S)CN(C)CC2=CC=C(C=C2)Br)C3=CC=CC=C3F

InChI

InChI=1S/C18H18BrFN4S/c1-22(11-13-7-9-14(19)10-8-13)12-24-18(25)23(2)17(21-24)15-5-3-4-6-16(15)20/h3-10H,11-12H2,1-2H3