4-(3-chloranyl-4-methoxy-phenyl)-3-(2-phenoxyethylsulfanyl)-5-phenyl-1,2,4-triazole

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C(=NN=C2SCCOC3=CC=CC=C3)C4=CC=CC=C4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)N2C(=NN=C2SCCOC3=CC=CC=C3)C4=CC=CC=C4)Cl

InChI

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