3-[2-(4-chloranylphenoxy)ethylsulfanyl]-4-phenyl-5-(phenylsulfonylmethyl)-1,2,4-triazole

Systemtic Name: 3-[2-(4-chloranylphenoxy)ethylsulfanyl]-4-phenyl-5-(phenylsulfonylmethyl)-1,2,4-triazole Openeye Name: 3-(benzenesulfonylmethyl)-5-[2-(4-chlorophenoxy)ethylsulfanyl]-4-phenyl-1,2,4-triazole CAS Name: 3-(benzenesulfonylmethyl)-5-[2-(4-chlorophenoxy)ethylthio]-4-phenyl-1,2,4-triazole IUPAC Name: 3-(benzenesulfonylmethyl)-5-[2-(4-chlorophenoxy)ethylsulfanyl]-4-phenyl-1,2,4-triazole Traditional Name: 3-(besylmethyl)-5-[2-(4-chlorophenoxy)ethylthio]-4-phenyl-1,2,4-triazole Formula: C23H20ClN3O3S2 MolecularWeight: 486.0062

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=C2SCCOC3=CC=C(C=C3)Cl)CS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=C2SCCOC3=CC=C(C=C3)Cl)CS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H20ClN3O3S2/c24-18-11-13-20(14-12-18)30-15-16-31-23-26-25-22(27(23)19-7-3-1-4-8-19)17-32(28,29)21-9-5-2-6-10-21/h1-14H,15-17H2