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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CSC2=NN=C(N2CC=C)COC3=CC=C(C=C3)Cl

Isomeric SMILES

COC1=CC=CC(=C1)CSC2=NN=C(N2CC=C)COC3=CC=C(C=C3)Cl

InChI

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