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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C=NN2C(=NN=C2[S-])COC3=CC=CC=C3

Isomeric SMILES

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

InChI

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