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

Systemtic Name: 2-[[(4-bromophenyl)methyl-methyl-amino]methyl]-5-phenyl-1H-1,2,4-triazole-3-thione Openeye Name: 2-[[(4-bromophenyl)methyl-methyl-amino]methyl]-5-phenyl-1H-1,2,4-triazole-3-thione CAS Name: 2-[[(4-bromophenyl)methyl-methylamino]methyl]-5-phenyl-1H-1,2,4-triazole-3-thione IUPAC Name: 2-[[(4-bromophenyl)methyl-methylamino]methyl]-5-phenyl-1H-1,2,4-triazole-3-thione Traditional Name: 2-[[(4-bromobenzyl)-methyl-amino]methyl]-5-phenyl-1H-1,2,4-triazole-3-thione Formula: C17H17BrN4S MolecularWeight: 389.31268

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)Br)CN2C(=S)N=C(N2)C3=CC=CC=C3

Isomeric SMILES

CN(CC1=CC=C(C=C1)Br)CN2C(=S)N=C(N2)C3=CC=CC=C3

InChI

InChI=1S/C17H17BrN4S/c1-21(11-13-7-9-15(18)10-8-13)12-22-17(23)19-16(20-22)14-5-3-2-4-6-14/h2-10H,11-12H2,1H3,(H,19,20,23)