2-[[2-(4-bromanylphenoxy)ethyl-methyl-amino]methyl]-5-(furan-2-yl)-4-methyl-1,2,4-triazole-3-thione

Systemtic Name: 2-[[2-(4-bromanylphenoxy)ethyl-methyl-amino]methyl]-5-(furan-2-yl)-4-methyl-1,2,4-triazole-3-thione Openeye Name: 2-[[2-(4-bromophenoxy)ethyl-methyl-amino]methyl]-5-(2-furyl)-4-methyl-1,2,4-triazole-3-thione CAS Name: 2-[[2-(4-bromophenoxy)ethyl-methylamino]methyl]-5-(2-furanyl)-4-methyl-1,2,4-triazole-3-thione IUPAC Name: 2-[[2-(4-bromophenoxy)ethyl-methylamino]methyl]-5-(furan-2-yl)-4-methyl-1,2,4-triazole-3-thione Traditional Name: 2-[[2-(4-bromophenoxy)ethyl-methyl-amino]methyl]-5-(2-furyl)-4-methyl-1,2,4-triazole-3-thione Formula: C17H19BrN4O2S MolecularWeight: 423.32736

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=S)CN(C)CCOC2=CC=C(C=C2)Br)C3=CC=CO3

Isomeric SMILES

CN1C(=NN(C1=S)CN(C)CCOC2=CC=C(C=C2)Br)C3=CC=CO3

InChI

InChI=1S/C17H19BrN4O2S/c1-20(9-11-23-14-7-5-13(18)6-8-14)12-22-17(25)21(2)16(19-22)15-4-3-10-24-15/h3-8,10H,9,11-12H2,1-2H3