4-[(Z)-(4-methylphenyl)methylideneamino]-5-(phenoxymethyl)-1,2,4-triazole-3-thiolate

Systemtic Name: 4-[(Z)-(4-methylphenyl)methylideneamino]-5-(phenoxymethyl)-1,2,4-triazole-3-thiolate Openeye Name: 5-(phenoxymethyl)-4-[(Z)-p-tolylmethyleneamino]-1,2,4-triazole-3-thiolate CAS Name: 4-[(Z)-(4-methylphenyl)methylideneamino]-5-(phenoxymethyl)-1,2,4-triazole-3-thiolate IUPAC Name: 4-[(Z)-(4-methylphenyl)methylideneamino]-5-(phenoxymethyl)-1,2,4-triazole-3-thiolate Traditional Name: 4-[(Z)-(4-methylbenzylidene)amino]-5-(phenoxymethyl)-1,2,4-triazole-3-thiolate Formula: C17H15N4OS- MolecularWeight: 323.3922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=NN2C(=NN=C2[S-])COC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)/C=N\N2C(=NN=C2[S-])COC3=CC=CC=C3

InChI

InChI=1S/C17H16N4OS/c1-13-7-9-14(10-8-13)11-18-21-16(19-20-17(21)23)12-22-15-5-3-2-4-6-15/h2-11H,12H2,1H3,(H,20,23)/p-1/b18-11-