4-(3-chlorophenyl)-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-olate

Systemtic Name: 4-(3-chlorophenyl)-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-olate Openeye Name: 5-benzylsulfanyl-4-(3-chlorophenyl)-1,2,4-triazol-3-olate CAS Name: 4-(3-chlorophenyl)-5-(phenylmethylthio)-1,2,4-triazol-3-olate IUPAC Name: 5-benzylsulfanyl-4-(3-chlorophenyl)-1,2,4-triazol-3-olate Traditional Name: 5-(benzylthio)-4-(3-chlorophenyl)-1,2,4-triazol-3-olate Formula: C15H11ClN3OS- MolecularWeight: 316.78534

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NN=C(N2C3=CC(=CC=C3)Cl)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NN=C(N2C3=CC(=CC=C3)Cl)[O-]

InChI

InChI=1S/C15H12ClN3OS/c16-12-7-4-8-13(9-12)19-14(20)17-18-15(19)21-10-11-5-2-1-3-6-11/h1-9H,10H2,(H,17,20)/p-1