5-phenethyl-1H-1,2,4-triazole-3-thiolate

Systemtic Name: 5-phenethyl-1H-1,2,4-triazole-3-thiolate Openeye Name: 5-phenethyl-1H-1,2,4-triazole-3-thiolate CAS Name: 5-phenethyl-1H-1,2,4-triazole-3-thiolate IUPAC Name: 5-phenethyl-1H-1,2,4-triazole-3-thiolate Traditional Name: 5-phenethyl-1H-1,2,4-triazole-3-thiolate Formula: C10H10N3S- MolecularWeight: 204.2715

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=NC(=NN2)[S-]

Isomeric SMILES

C1=CC=C(C=C1)CCC2=NC(=NN2)[S-]

InChI

InChI=1S/C10H11N3S/c14-10-11-9(12-13-10)7-6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H2,11,12,13,14)/p-1