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

Systemtic Name: 5-(furan-2-yl)-4-(3-methylphenyl)-1,2,4-triazole-3-thiolate Openeye Name: 5-(2-furyl)-4-(m-tolyl)-1,2,4-triazole-3-thiolate CAS Name: 5-(2-furanyl)-4-(3-methylphenyl)-1,2,4-triazole-3-thiolate IUPAC Name: 5-(furan-2-yl)-4-(3-methylphenyl)-1,2,4-triazole-3-thiolate Traditional Name: 5-(2-furyl)-4-(m-tolyl)-1,2,4-triazole-3-thiolate Formula: C13H10N3OS- MolecularWeight: 256.303

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=NN=C2[S-])C3=CC=CO3

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=NN=C2[S-])C3=CC=CO3

InChI

InChI=1S/C13H11N3OS/c1-9-4-2-5-10(8-9)16-12(14-15-13(16)18)11-6-3-7-17-11/h2-8H,1H3,(H,15,18)/p-1