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

Systemtic Name: 4-(3-iodanylphenyl)-5-phenyl-1,2,4-triazole-3-thiolate Openeye Name: 4-(3-iodophenyl)-5-phenyl-1,2,4-triazole-3-thiolate CAS Name: 4-(3-iodophenyl)-5-phenyl-1,2,4-triazole-3-thiolate IUPAC Name: 4-(3-iodophenyl)-5-phenyl-1,2,4-triazole-3-thiolate Traditional Name: 4-(3-iodophenyl)-5-phenyl-1,2,4-triazole-3-thiolate Formula: C14H9IN3S- MolecularWeight: 378.21083

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=C(N2C3=CC(=CC=C3)I)[S-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(N2C3=CC(=CC=C3)I)[S-]

InChI

InChI=1S/C14H10IN3S/c15-11-7-4-8-12(9-11)18-13(16-17-14(18)19)10-5-2-1-3-6-10/h1-9H,(H,17,19)/p-1