3-[2-(4-chloranylphenoxy)ethylsulfanyl]-5-(3-methoxyphenyl)-4-methyl-1,2,4-triazole

Systemtic Name: 3-[2-(4-chloranylphenoxy)ethylsulfanyl]-5-(3-methoxyphenyl)-4-methyl-1,2,4-triazole Openeye Name: 3-[2-(4-chlorophenoxy)ethylsulfanyl]-5-(3-methoxyphenyl)-4-methyl-1,2,4-triazole CAS Name: 3-[2-(4-chlorophenoxy)ethylthio]-5-(3-methoxyphenyl)-4-methyl-1,2,4-triazole IUPAC Name: 3-[2-(4-chlorophenoxy)ethylsulfanyl]-5-(3-methoxyphenyl)-4-methyl-1,2,4-triazole Traditional Name: 3-[2-(4-chlorophenoxy)ethylthio]-5-(3-methoxyphenyl)-4-methyl-1,2,4-triazole Formula: C18H18ClN3O2S MolecularWeight: 375.87242

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCCOC2=CC=C(C=C2)Cl)C3=CC(=CC=C3)OC

Isomeric SMILES

CN1C(=NN=C1SCCOC2=CC=C(C=C2)Cl)C3=CC(=CC=C3)OC

InChI

InChI=1S/C18H18ClN3O2S/c1-22-17(13-4-3-5-16(12-13)23-2)20-21-18(22)25-11-10-24-15-8-6-14(19)7-9-15/h3-9,12H,10-11H2,1-2H3