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

Systemtic Name: 3-[2-(3-chloranylphenoxy)ethylsulfanyl]-5-(3-methoxyphenyl)-4-methyl-1,2,4-triazole Openeye Name: 3-[2-(3-chlorophenoxy)ethylsulfanyl]-5-(3-methoxyphenyl)-4-methyl-1,2,4-triazole CAS Name: 3-[2-(3-chlorophenoxy)ethylthio]-5-(3-methoxyphenyl)-4-methyl-1,2,4-triazole IUPAC Name: 3-[2-(3-chlorophenoxy)ethylsulfanyl]-5-(3-methoxyphenyl)-4-methyl-1,2,4-triazole Traditional Name: 3-[2-(3-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(=CC=C2)Cl)C3=CC(=CC=C3)OC

Isomeric SMILES

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

InChI

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