N-(1,3-benzodioxol-5-ylmethyl)-2-(3-cyano-6-phenyl-4-thiophen-2-yl-pyridin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3-cyano-6-phenyl-4-thiophen-2-yl-pyridin-2-yl)sulfanyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[3-cyano-6-phenyl-4-(2-thienyl)-2-pyridyl]sulfanyl]acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(3-cyano-6-phenyl-4-thiophen-2-yl-2-pyridinyl)thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3-cyano-6-phenyl-4-thiophen-2-ylpyridin-2-yl)sulfanylacetamide Traditional Name: 2-[[3-cyano-6-phenyl-4-(2-thienyl)-2-pyridyl]thio]-N-piperonyl-acetamide Formula: C26H19N3O3S2 MolecularWeight: 485.57736

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)CSC3=C(C(=CC(=N3)C4=CC=CC=C4)C5=CC=CS5)C#N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)CSC3=C(C(=CC(=N3)C4=CC=CC=C4)C5=CC=CS5)C#N

InChI

InChI=1S/C26H19N3O3S2/c27-13-20-19(24-7-4-10-33-24)12-21(18-5-2-1-3-6-18)29-26(20)34-15-25(30)28-14-17-8-9-22-23(11-17)32-16-31-22/h1-12H,14-16H2,(H,28,30)