3-(5-bromanylfuran-2-yl)-5-[(4-methoxyphenyl)methylsulfanyl]-4-(phenylmethyl)-1,2,4-triazole

Systemtic Name: 3-(5-bromanylfuran-2-yl)-5-[(4-methoxyphenyl)methylsulfanyl]-4-(phenylmethyl)-1,2,4-triazole Openeye Name: 4-benzyl-3-(5-bromo-2-furyl)-5-[(4-methoxyphenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 3-(5-bromo-2-furanyl)-5-[(4-methoxyphenyl)methylthio]-4-(phenylmethyl)-1,2,4-triazole IUPAC Name: 4-benzyl-3-(5-bromofuran-2-yl)-5-[(4-methoxyphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 4-benzyl-3-(5-bromo-2-furyl)-5-(p-anisylthio)-1,2,4-triazole Formula: C21H18BrN3O2S MolecularWeight: 456.35552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CSC2=NN=C(N2CC3=CC=CC=C3)C4=CC=C(O4)Br

Isomeric SMILES

COC1=CC=C(C=C1)CSC2=NN=C(N2CC3=CC=CC=C3)C4=CC=C(O4)Br

InChI

InChI=1S/C21H18BrN3O2S/c1-26-17-9-7-16(8-10-17)14-28-21-24-23-20(18-11-12-19(22)27-18)25(21)13-15-5-3-2-4-6-15/h2-12H,13-14H2,1H3