3-[2-(4-bromanylphenoxy)ethylsulfanyl]-5-[(4-ethylphenoxy)methyl]-4-prop-2-enyl-1,2,4-triazole

Systemtic Name: 3-[2-(4-bromanylphenoxy)ethylsulfanyl]-5-[(4-ethylphenoxy)methyl]-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-[2-(4-bromophenoxy)ethylsulfanyl]-5-[(4-ethylphenoxy)methyl]-1,2,4-triazole CAS Name: 3-[2-(4-bromophenoxy)ethylthio]-5-[(4-ethylphenoxy)methyl]-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-[2-(4-bromophenoxy)ethylsulfanyl]-5-[(4-ethylphenoxy)methyl]-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-[2-(4-bromophenoxy)ethylthio]-5-[(4-ethylphenoxy)methyl]-1,2,4-triazole Formula: C22H24BrN3O2S MolecularWeight: 474.41386

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCC2=NN=C(N2CC=C)SCCOC3=CC=C(C=C3)Br

Isomeric SMILES

CCC1=CC=C(C=C1)OCC2=NN=C(N2CC=C)SCCOC3=CC=C(C=C3)Br

InChI

InChI=1S/C22H24BrN3O2S/c1-3-13-26-21(16-28-20-9-5-17(4-2)6-10-20)24-25-22(26)29-15-14-27-19-11-7-18(23)8-12-19/h3,5-12H,1,4,13-16H2,2H3