4-(4-methylphenyl)-5-pyridin-4-yl-1,2,4-triazole-3-thiolate

Systemtic Name: 4-(4-methylphenyl)-5-pyridin-4-yl-1,2,4-triazole-3-thiolate Openeye Name: 4-(p-tolyl)-5-(4-pyridyl)-1,2,4-triazole-3-thiolate CAS Name: 4-(4-methylphenyl)-5-pyridin-4-yl-1,2,4-triazole-3-thiolate IUPAC Name: 4-(4-methylphenyl)-5-pyridin-4-yl-1,2,4-triazole-3-thiolate Traditional Name: 4-(p-tolyl)-5-(4-pyridyl)-1,2,4-triazole-3-thiolate Formula: C14H11N4S- MolecularWeight: 267.32894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2[S-])C3=CC=NC=C3

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2[S-])C3=CC=NC=C3

InChI

InChI=1S/C14H12N4S/c1-10-2-4-12(5-3-10)18-13(16-17-14(18)19)11-6-8-15-9-7-11/h2-9H,1H3,(H,17,19)/p-1