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

Systemtic Name: 5-(5-chloranyl-2-methoxy-phenyl)-3-(2-phenoxyethylsulfanyl)-1H-1,2,4-triazole Openeye Name: 5-(5-chloro-2-methoxy-phenyl)-3-(2-phenoxyethylsulfanyl)-1H-1,2,4-triazole CAS Name: 5-(5-chloro-2-methoxyphenyl)-3-(2-phenoxyethylthio)-1H-1,2,4-triazole IUPAC Name: 5-(5-chloro-2-methoxyphenyl)-3-(2-phenoxyethylsulfanyl)-1H-1,2,4-triazole Traditional Name: 5-(5-chloro-2-methoxy-phenyl)-3-(2-phenoxyethylthio)-1H-1,2,4-triazole Formula: C17H16ClN3O2S MolecularWeight: 361.84584

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C2=NC(=NN2)SCCOC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C2=NC(=NN2)SCCOC3=CC=CC=C3

InChI

InChI=1S/C17H16ClN3O2S/c1-22-15-8-7-12(18)11-14(15)16-19-17(21-20-16)24-10-9-23-13-5-3-2-4-6-13/h2-8,11H,9-10H2,1H3,(H,19,20,21)