3-(4-chlorophenyl)-5-[2-(2-methoxyphenoxy)ethylsulfanyl]-4-prop-2-enyl-1,2,4-triazole

Systemtic Name: 3-(4-chlorophenyl)-5-[2-(2-methoxyphenoxy)ethylsulfanyl]-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-(4-chlorophenyl)-5-[2-(2-methoxyphenoxy)ethylsulfanyl]-1,2,4-triazole CAS Name: 3-(4-chlorophenyl)-5-[2-(2-methoxyphenoxy)ethylthio]-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-(4-chlorophenyl)-5-[2-(2-methoxyphenoxy)ethylsulfanyl]-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-(4-chlorophenyl)-5-[2-(2-methoxyphenoxy)ethylthio]-1,2,4-triazole Formula: C20H20ClN3O2S MolecularWeight: 401.9097

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OCCSC2=NN=C(N2CC=C)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC1=CC=CC=C1OCCSC2=NN=C(N2CC=C)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H20ClN3O2S/c1-3-12-24-19(15-8-10-16(21)11-9-15)22-23-20(24)27-14-13-26-18-7-5-4-6-17(18)25-2/h3-11H,1,12-14H2,2H3