5-oxidanylidene-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]-5-thiophen-2-yl-pentanamide

Systemtic Name: 5-oxidanylidene-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]-5-thiophen-2-yl-pentanamide Openeye Name: 5-oxo-N-[4-(3-pyridylmethylsulfanyl)phenyl]-5-(2-thienyl)pentanamide CAS Name: 5-oxo-N-[4-(3-pyridinylmethylthio)phenyl]-5-thiophen-2-ylpentanamide IUPAC Name: 5-oxo-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]-5-thiophen-2-ylpentanamide Traditional Name: 5-keto-N-[4-(3-pyridylmethylthio)phenyl]-5-(2-thienyl)valeramide Formula: C21H20N2O2S2 MolecularWeight: 396.5257

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CSC2=CC=C(C=C2)NC(=O)CCCC(=O)C3=CC=CS3

Isomeric SMILES

C1=CC(=CN=C1)CSC2=CC=C(C=C2)NC(=O)CCCC(=O)C3=CC=CS3

InChI

InChI=1S/C21H20N2O2S2/c24-19(20-6-3-13-26-20)5-1-7-21(25)23-17-8-10-18(11-9-17)27-15-16-4-2-12-22-14-16/h2-4,6,8-14H,1,5,7,15H2,(H,23,25)