5-(3-bromophenyl)-4-phenyl-1,2,4-triazole-3-thiolate

Systemtic Name: 5-(3-bromophenyl)-4-phenyl-1,2,4-triazole-3-thiolate Openeye Name: 5-(3-bromophenyl)-4-phenyl-1,2,4-triazole-3-thiolate CAS Name: 5-(3-bromophenyl)-4-phenyl-1,2,4-triazole-3-thiolate IUPAC Name: 5-(3-bromophenyl)-4-phenyl-1,2,4-triazole-3-thiolate Traditional Name: 5-(3-bromophenyl)-4-phenyl-1,2,4-triazole-3-thiolate Formula: C14H9BrN3S- MolecularWeight: 331.21036

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=C2[S-])C3=CC(=CC=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=C2[S-])C3=CC(=CC=C3)Br

InChI

InChI=1S/C14H10BrN3S/c15-11-6-4-5-10(9-11)13-16-17-14(19)18(13)12-7-2-1-3-8-12/h1-9H,(H,17,19)/p-1