3-[(4-bromophenyl)methylsulfanyl]-5-[(3,4-dimethoxyphenyl)methyl]-4-methyl-1,2,4-triazole

Systemtic Name: 3-[(4-bromophenyl)methylsulfanyl]-5-[(3,4-dimethoxyphenyl)methyl]-4-methyl-1,2,4-triazole Openeye Name: 3-[(4-bromophenyl)methylsulfanyl]-5-[(3,4-dimethoxyphenyl)methyl]-4-methyl-1,2,4-triazole CAS Name: 3-[(4-bromophenyl)methylthio]-5-[(3,4-dimethoxyphenyl)methyl]-4-methyl-1,2,4-triazole IUPAC Name: 3-[(4-bromophenyl)methylsulfanyl]-5-[(3,4-dimethoxyphenyl)methyl]-4-methyl-1,2,4-triazole Traditional Name: 3-[(4-bromobenzyl)thio]-4-methyl-5-veratryl-1,2,4-triazole Formula: C19H20BrN3O2S MolecularWeight: 434.35

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC=C(C=C2)Br)CC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CN1C(=NN=C1SCC2=CC=C(C=C2)Br)CC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C19H20BrN3O2S/c1-23-18(11-14-6-9-16(24-2)17(10-14)25-3)21-22-19(23)26-12-13-4-7-15(20)8-5-13/h4-10H,11-12H2,1-3H3