3-[1-(4-chloranyl-3-methyl-phenoxy)ethyl]-5-(naphthalen-1-ylmethylsulfanyl)-4-prop-2-enyl-1,2,4-triazole

Systemtic Name: 3-[1-(4-chloranyl-3-methyl-phenoxy)ethyl]-5-(naphthalen-1-ylmethylsulfanyl)-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-[1-(4-chloro-3-methyl-phenoxy)ethyl]-5-(1-naphthylmethylsulfanyl)-1,2,4-triazole CAS Name: 3-[1-(4-chloro-3-methylphenoxy)ethyl]-5-(1-naphthalenylmethylthio)-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-[1-(4-chloro-3-methylphenoxy)ethyl]-5-(naphthalen-1-ylmethylsulfanyl)-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-[1-(4-chloro-3-methyl-phenoxy)ethyl]-5-(1-naphthylmethylthio)-1,2,4-triazole Formula: C25H24ClN3OS MolecularWeight: 449.99556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC(C)C2=NN=C(N2CC=C)SCC3=CC=CC4=CC=CC=C43)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OC(C)C2=NN=C(N2CC=C)SCC3=CC=CC4=CC=CC=C43)Cl

InChI

InChI=1S/C25H24ClN3OS/c1-4-14-29-24(18(3)30-21-12-13-23(26)17(2)15-21)27-28-25(29)31-16-20-10-7-9-19-8-5-6-11-22(19)20/h4-13,15,18H,1,14,16H2,2-3H3