3-[(3-methoxyphenyl)methylsulfanyl]-5-[(E)-2-thiophen-2-ylethenyl]-1H-1,2,4-triazole

Systemtic Name: 3-[(3-methoxyphenyl)methylsulfanyl]-5-[(E)-2-thiophen-2-ylethenyl]-1H-1,2,4-triazole Openeye Name: 3-[(3-methoxyphenyl)methylsulfanyl]-5-[(E)-2-(2-thienyl)vinyl]-1H-1,2,4-triazole CAS Name: 3-[(3-methoxyphenyl)methylthio]-5-[(E)-2-thiophen-2-ylethenyl]-1H-1,2,4-triazole IUPAC Name: 3-[(3-methoxyphenyl)methylsulfanyl]-5-[(E)-2-thiophen-2-ylethenyl]-1H-1,2,4-triazole Traditional Name: 3-(m-anisylthio)-5-[(E)-2-(2-thienyl)vinyl]-1H-1,2,4-triazole Formula: C16H15N3OS2 MolecularWeight: 329.4398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CSC2=NNC(=N2)C=CC3=CC=CS3

Isomeric SMILES

COC1=CC=CC(=C1)CSC2=NNC(=N2)/C=C/C3=CC=CS3

InChI

InChI=1S/C16H15N3OS2/c1-20-13-5-2-4-12(10-13)11-22-16-17-15(18-19-16)8-7-14-6-3-9-21-14/h2-10H,11H2,1H3,(H,17,18,19)/b8-7+