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

Systemtic Name: 2-[[(4-bromophenyl)methyl-methyl-amino]methyl]-4-methyl-5-(phenylmethyl)-1,2,4-triazole-3-thione Openeye Name: 5-benzyl-2-[[(4-bromophenyl)methyl-methyl-amino]methyl]-4-methyl-1,2,4-triazole-3-thione CAS Name: 2-[[(4-bromophenyl)methyl-methylamino]methyl]-4-methyl-5-(phenylmethyl)-1,2,4-triazole-3-thione IUPAC Name: 5-benzyl-2-[[(4-bromophenyl)methyl-methylamino]methyl]-4-methyl-1,2,4-triazole-3-thione Traditional Name: 5-benzyl-2-[[(4-bromobenzyl)-methyl-amino]methyl]-4-methyl-1,2,4-triazole-3-thione Formula: C19H21BrN4S MolecularWeight: 417.36584

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=S)CN(C)CC2=CC=C(C=C2)Br)CC3=CC=CC=C3

Isomeric SMILES

CN1C(=NN(C1=S)CN(C)CC2=CC=C(C=C2)Br)CC3=CC=CC=C3

InChI

InChI=1S/C19H21BrN4S/c1-22(13-16-8-10-17(20)11-9-16)14-24-19(25)23(2)18(21-24)12-15-6-4-3-5-7-15/h3-11H,12-14H2,1-2H3