5-(4-bromanylthiophen-2-yl)-4-(2-methylpropyl)-1,2,4-triazole-3-thiolate

Systemtic Name: 5-(4-bromanylthiophen-2-yl)-4-(2-methylpropyl)-1,2,4-triazole-3-thiolate Openeye Name: 5-(4-bromo-2-thienyl)-4-isobutyl-1,2,4-triazole-3-thiolate CAS Name: 5-(4-bromo-2-thiophenyl)-4-(2-methylpropyl)-1,2,4-triazole-3-thiolate IUPAC Name: 5-(4-bromothiophen-2-yl)-4-(2-methylpropyl)-1,2,4-triazole-3-thiolate Traditional Name: 5-(4-bromo-2-thienyl)-4-isobutyl-1,2,4-triazole-3-thiolate Formula: C10H11BrN3S2- MolecularWeight: 317.24844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=NN=C1[S-])C2=CC(=CS2)Br

Isomeric SMILES

CC(C)CN1C(=NN=C1[S-])C2=CC(=CS2)Br

InChI

InChI=1S/C10H12BrN3S2/c1-6(2)4-14-9(12-13-10(14)15)8-3-7(11)5-16-8/h3,5-6H,4H2,1-2H3,(H,13,15)/p-1