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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN=C(N2CC=C)SCCOC3=CC=CC=C3Cl

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN=C(N2CC=C)SCCOC3=CC=CC=C3Cl

InChI

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