3-[(3-bromanyl-4-methoxy-phenyl)methylsulfanyl]-5-[(4-methoxyphenyl)methyl]-4-phenyl-1,2,4-triazole

Systemtic Name: 3-[(3-bromanyl-4-methoxy-phenyl)methylsulfanyl]-5-[(4-methoxyphenyl)methyl]-4-phenyl-1,2,4-triazole Openeye Name: 3-[(3-bromo-4-methoxy-phenyl)methylsulfanyl]-5-[(4-methoxyphenyl)methyl]-4-phenyl-1,2,4-triazole CAS Name: 3-[(3-bromo-4-methoxyphenyl)methylthio]-5-[(4-methoxyphenyl)methyl]-4-phenyl-1,2,4-triazole IUPAC Name: 3-[(3-bromo-4-methoxyphenyl)methylsulfanyl]-5-[(4-methoxyphenyl)methyl]-4-phenyl-1,2,4-triazole Traditional Name: 3-[(3-bromo-4-methoxy-benzyl)thio]-5-p-anisyl-4-phenyl-1,2,4-triazole Formula: C24H22BrN3O2S MolecularWeight: 496.41938

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=NN=C(N2C3=CC=CC=C3)SCC4=CC(=C(C=C4)OC)Br

Isomeric SMILES

COC1=CC=C(C=C1)CC2=NN=C(N2C3=CC=CC=C3)SCC4=CC(=C(C=C4)OC)Br

InChI

InChI=1S/C24H22BrN3O2S/c1-29-20-11-8-17(9-12-20)15-23-26-27-24(28(23)19-6-4-3-5-7-19)31-16-18-10-13-22(30-2)21(25)14-18/h3-14H,15-16H2,1-2H3