4-(4-chlorophenyl)-3-(2-methoxyphenyl)-5-(2-phenoxyethylsulfanyl)-1,2,4-triazole

Systemtic Name: 4-(4-chlorophenyl)-3-(2-methoxyphenyl)-5-(2-phenoxyethylsulfanyl)-1,2,4-triazole Openeye Name: 4-(4-chlorophenyl)-3-(2-methoxyphenyl)-5-(2-phenoxyethylsulfanyl)-1,2,4-triazole CAS Name: 4-(4-chlorophenyl)-3-(2-methoxyphenyl)-5-(2-phenoxyethylthio)-1,2,4-triazole IUPAC Name: 4-(4-chlorophenyl)-3-(2-methoxyphenyl)-5-(2-phenoxyethylsulfanyl)-1,2,4-triazole Traditional Name: 4-(4-chlorophenyl)-3-(2-methoxyphenyl)-5-(2-phenoxyethylthio)-1,2,4-triazole Formula: C23H20ClN3O2S MolecularWeight: 437.9418

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NN=C(N2C3=CC=C(C=C3)Cl)SCCOC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1C2=NN=C(N2C3=CC=C(C=C3)Cl)SCCOC4=CC=CC=C4

InChI

InChI=1S/C23H20ClN3O2S/c1-28-21-10-6-5-9-20(21)22-25-26-23(27(22)18-13-11-17(24)12-14-18)30-16-15-29-19-7-3-2-4-8-19/h2-14H,15-16H2,1H3