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

Systemtic Name: sodium 4-phenyl-5-(phenylmethyl)-1,2,4-triazole-3-thiolate Openeye Name: sodium 5-benzyl-4-phenyl-1,2,4-triazole-3-thiolate CAS Name: sodium 4-phenyl-5-(phenylmethyl)-1,2,4-triazole-3-thiolate IUPAC Name: sodium 5-benzyl-4-phenyl-1,2,4-triazole-3-thiolate Traditional Name: sodium 5-benzyl-4-phenyl-1,2,4-triazole-3-thiolate Formula: C15H12N3NaS MolecularWeight: 289.33065

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NN=C(N2C3=CC=CC=C3)[S-].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)CC2=NN=C(N2C3=CC=CC=C3)[S-].[Na+]

InChI

InChI=1S/C15H13N3S.Na/c19-15-17-16-14(11-12-7-3-1-4-8-12)18(15)13-9-5-2-6-10-13;/h1-10H,11H2,(H,17,19);/q;+1/p-1