4-phenyl-5-[(2-prop-2-enylphenoxy)methyl]-1,2,4-triazole-3-thiolate

Systemtic Name: 4-phenyl-5-[(2-prop-2-enylphenoxy)methyl]-1,2,4-triazole-3-thiolate Openeye Name: 5-[(2-allylphenoxy)methyl]-4-phenyl-1,2,4-triazole-3-thiolate CAS Name: 4-phenyl-5-[(2-prop-2-enylphenoxy)methyl]-1,2,4-triazole-3-thiolate IUPAC Name: 4-phenyl-5-[(2-prop-2-enylphenoxy)methyl]-1,2,4-triazole-3-thiolate Traditional Name: 5-[(2-allylphenoxy)methyl]-4-phenyl-1,2,4-triazole-3-thiolate Formula: C18H16N3OS- MolecularWeight: 322.40414

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=CC=CC=C1OCC2=NN=C(N2C3=CC=CC=C3)[S-]

Isomeric SMILES

C=CCC1=CC=CC=C1OCC2=NN=C(N2C3=CC=CC=C3)[S-]

InChI

InChI=1S/C18H17N3OS/c1-2-8-14-9-6-7-12-16(14)22-13-17-19-20-18(23)21(17)15-10-4-3-5-11-15/h2-7,9-12H,1,8,13H2,(H,20,23)/p-1