2-[[5-[(4-methoxyphenyl)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-ethanamide

Systemtic Name: 2-[[5-[(4-methoxyphenyl)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-ethanamide Openeye Name: 2-[[5-[(4-methoxyphenyl)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-acetamide CAS Name: 2-[[5-[(4-methoxyphenyl)methyl]-1H-1,2,4-triazol-3-yl]thio]-N-phenylacetamide IUPAC Name: 2-[[5-[(4-methoxyphenyl)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide Traditional Name: 2-[(5-p-anisyl-1H-1,2,4-triazol-3-yl)thio]-N-phenyl-acetamide Formula: C18H18N4O2S MolecularWeight: 354.42612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=NC(=NN2)SCC(=O)NC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)CC2=NC(=NN2)SCC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C18H18N4O2S/c1-24-15-9-7-13(8-10-15)11-16-20-18(22-21-16)25-12-17(23)19-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3,(H,19,23)(H,20,21,22)