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

Systemtic Name: 3-[(2-chloranyl-5-methyl-phenoxy)methyl]-5-[(3-methoxyphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-[(2-chloro-5-methyl-phenoxy)methyl]-5-[(3-methoxyphenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 3-[(2-chloro-5-methylphenoxy)methyl]-5-[(3-methoxyphenyl)methylthio]-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-[(2-chloro-5-methylphenoxy)methyl]-5-[(3-methoxyphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-[(2-chloro-5-methyl-phenoxy)methyl]-5-(m-anisylthio)-1,2,4-triazole Formula: C21H22ClN3O2S MolecularWeight: 415.93628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Cl)OCC2=NN=C(N2CC=C)SCC3=CC(=CC=C3)OC

Isomeric SMILES

CC1=CC(=C(C=C1)Cl)OCC2=NN=C(N2CC=C)SCC3=CC(=CC=C3)OC

InChI

InChI=1S/C21H22ClN3O2S/c1-4-10-25-20(13-27-19-11-15(2)8-9-18(19)22)23-24-21(25)28-14-16-6-5-7-17(12-16)26-3/h4-9,11-12H,1,10,13-14H2,2-3H3