5-[(4-methoxyphenyl)methyl]-3-[(3-methylthiophen-2-yl)methylsulfanyl]-1H-1,2,4-triazole

Systemtic Name: 5-[(4-methoxyphenyl)methyl]-3-[(3-methylthiophen-2-yl)methylsulfanyl]-1H-1,2,4-triazole Openeye Name: 5-[(4-methoxyphenyl)methyl]-3-[(3-methyl-2-thienyl)methylsulfanyl]-1H-1,2,4-triazole CAS Name: 5-[(4-methoxyphenyl)methyl]-3-[(3-methyl-2-thiophenyl)methylthio]-1H-1,2,4-triazole IUPAC Name: 5-[(4-methoxyphenyl)methyl]-3-[(3-methylthiophen-2-yl)methylsulfanyl]-1H-1,2,4-triazole Traditional Name: 3-[(3-methyl-2-thienyl)methylthio]-5-p-anisyl-1H-1,2,4-triazole Formula: C16H17N3OS2 MolecularWeight: 331.45568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CSC2=NNC(=N2)CC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(SC=C1)CSC2=NNC(=N2)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C16H17N3OS2/c1-11-7-8-21-14(11)10-22-16-17-15(18-19-16)9-12-3-5-13(20-2)6-4-12/h3-8H,9-10H2,1-2H3,(H,17,18,19)