4-(4-chlorophenyl)-3-(4-methoxyphenyl)-5-[(3-methoxyphenyl)methylsulfanyl]-1,2,4-triazole

Systemtic Name: 4-(4-chlorophenyl)-3-(4-methoxyphenyl)-5-[(3-methoxyphenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 4-(4-chlorophenyl)-3-(4-methoxyphenyl)-5-[(3-methoxyphenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 4-(4-chlorophenyl)-3-(4-methoxyphenyl)-5-[(3-methoxyphenyl)methylthio]-1,2,4-triazole IUPAC Name: 4-(4-chlorophenyl)-3-(4-methoxyphenyl)-5-[(3-methoxyphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 4-(4-chlorophenyl)-3-(m-anisylthio)-5-(4-methoxyphenyl)-1,2,4-triazole Formula: C23H20ClN3O2S MolecularWeight: 437.9418

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC4=CC(=CC=C4)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC4=CC(=CC=C4)OC

InChI

InChI=1S/C23H20ClN3O2S/c1-28-20-12-6-17(7-13-20)22-25-26-23(27(22)19-10-8-18(24)9-11-19)30-15-16-4-3-5-21(14-16)29-2/h3-14H,15H2,1-2H3