3-(2-methoxyphenyl)-5-[(4-phenylphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole

Systemtic Name: 3-(2-methoxyphenyl)-5-[(4-phenylphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-(2-methoxyphenyl)-5-[(4-phenylphenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 3-(2-methoxyphenyl)-5-[(4-phenylphenyl)methylthio]-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-(2-methoxyphenyl)-5-[(4-phenylphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-(2-methoxyphenyl)-5-[(4-phenylbenzyl)thio]-1,2,4-triazole Formula: C25H23N3OS MolecularWeight: 413.53462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NN=C(N2CC=C)SCC3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1C2=NN=C(N2CC=C)SCC3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H23N3OS/c1-3-17-28-24(22-11-7-8-12-23(22)29-2)26-27-25(28)30-18-19-13-15-21(16-14-19)20-9-5-4-6-10-20/h3-16H,1,17-18H2,2H3