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

Systemtic Name: sodium 5-(4-chlorophenyl)-4-(phenylmethyl)-1,2,4-triazole-3-thiolate Openeye Name: sodium 4-benzyl-5-(4-chlorophenyl)-1,2,4-triazole-3-thiolate CAS Name: sodium 5-(4-chlorophenyl)-4-(phenylmethyl)-1,2,4-triazole-3-thiolate IUPAC Name: sodium 4-benzyl-5-(4-chlorophenyl)-1,2,4-triazole-3-thiolate Traditional Name: sodium 4-benzyl-5-(4-chlorophenyl)-1,2,4-triazole-3-thiolate Formula: C15H11ClN3NaS MolecularWeight: 323.77571

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=NN=C2[S-])C3=CC=C(C=C3)Cl.[Na+]

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=NN=C2[S-])C3=CC=C(C=C3)Cl.[Na+]

InChI

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