3-(4-bromophenyl)-4-pyridin-3-yl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(4-bromophenyl)-4-pyridin-3-yl-1H-1,2,4-triazole-5-thione Openeye Name: 3-(4-bromophenyl)-4-(3-pyridyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-(4-bromophenyl)-4-(3-pyridinyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(4-bromophenyl)-4-pyridin-3-yl-1H-1,2,4-triazole-5-thione Traditional Name: 3-(4-bromophenyl)-4-(3-pyridyl)-1H-1,2,4-triazole-5-thione Formula: C13H9BrN4S MolecularWeight: 333.20636

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)N2C(=NNC2=S)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC(=CN=C1)N2C(=NNC2=S)C3=CC=C(C=C3)Br

InChI

InChI=1S/C13H9BrN4S/c14-10-5-3-9(4-6-10)12-16-17-13(19)18(12)11-2-1-7-15-8-11/h1-8H,(H,17,19)