5-ethynyl-N-[[1-[4-(2-oxidanylidenepyridin-1-yl)phenyl]imidazol-4-yl]methyl]thiophene-2-carboxamide

Systemtic Name: 5-ethynyl-N-[[1-[4-(2-oxidanylidenepyridin-1-yl)phenyl]imidazol-4-yl]methyl]thiophene-2-carboxamide Openeye Name: 5-ethynyl-N-[[1-[4-(2-oxo-1-pyridyl)phenyl]imidazol-4-yl]methyl]thiophene-2-carboxamide CAS Name: 5-ethynyl-N-[[1-[4-(2-oxo-1-pyridinyl)phenyl]-4-imidazolyl]methyl]-2-thiophenecarboxamide IUPAC Name: 5-ethynyl-N-[[1-[4-(2-oxopyridin-1-yl)phenyl]imidazol-4-yl]methyl]thiophene-2-carboxamide Traditional Name: 5-ethynyl-N-[[1-[4-(2-keto-1-pyridyl)phenyl]imidazol-4-yl]methyl]thiophene-2-carboxamide Formula: C22H16N4O2S MolecularWeight: 400.45304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC=C(S1)C(=O)NCC2=CN(C=N2)C3=CC=C(C=C3)N4C=CC=CC4=O

Isomeric SMILES

C#CC1=CC=C(S1)C(=O)NCC2=CN(C=N2)C3=CC=C(C=C3)N4C=CC=CC4=O

InChI

InChI=1S/C22H16N4O2S/c1-2-19-10-11-20(29-19)22(28)23-13-16-14-25(15-24-16)17-6-8-18(9-7-17)26-12-4-3-5-21(26)27/h1,3-12,14-15H,13H2,(H,23,28)