4-(4-chlorophenyl)-5-(phenylmethyl)-1,2,4-triazole-3-thiolate

Systemtic Name: 4-(4-chlorophenyl)-5-(phenylmethyl)-1,2,4-triazole-3-thiolate Openeye Name: 5-benzyl-4-(4-chlorophenyl)-1,2,4-triazole-3-thiolate CAS Name: 4-(4-chlorophenyl)-5-(phenylmethyl)-1,2,4-triazole-3-thiolate IUPAC Name: 5-benzyl-4-(4-chlorophenyl)-1,2,4-triazole-3-thiolate Traditional Name: 5-benzyl-4-(4-chlorophenyl)-1,2,4-triazole-3-thiolate Formula: C15H11ClN3S- MolecularWeight: 300.78594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NN=C(N2C3=CC=C(C=C3)Cl)[S-]

Isomeric SMILES

C1=CC=C(C=C1)CC2=NN=C(N2C3=CC=C(C=C3)Cl)[S-]

InChI

InChI=1S/C15H12ClN3S/c16-12-6-8-13(9-7-12)19-14(17-18-15(19)20)10-11-4-2-1-3-5-11/h1-9H,10H2,(H,18,20)/p-1