2-(3-cyano-6-thiophen-2-yl-pyridin-1-ium-2-yl)sulfanyl-N-cyclopropyl-ethanamide

Systemtic Name: 2-(3-cyano-6-thiophen-2-yl-pyridin-1-ium-2-yl)sulfanyl-N-cyclopropyl-ethanamide Openeye Name: 2-[3-cyano-6-(2-thienyl)pyridin-1-ium-2-yl]sulfanyl-N-cyclopropyl-acetamide CAS Name: 2-[(3-cyano-6-thiophen-2-yl-2-pyridin-1-iumyl)thio]-N-cyclopropylacetamide IUPAC Name: 2-(3-cyano-6-thiophen-2-ylpyridin-1-ium-2-yl)sulfanyl-N-cyclopropylacetamide Traditional Name: 2-[[3-cyano-6-(2-thienyl)pyridin-1-ium-2-yl]thio]-N-cyclopropyl-acetamide Formula: C15H14N3OS2+ MolecularWeight: 316.42116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)CSC2=C(C=CC(=[NH+]2)C3=CC=CS3)C#N

Isomeric SMILES

C1CC1NC(=O)CSC2=C(C=CC(=[NH+]2)C3=CC=CS3)C#N

InChI

InChI=1S/C15H13N3OS2/c16-8-10-3-6-12(13-2-1-7-20-13)18-15(10)21-9-14(19)17-11-4-5-11/h1-3,6-7,11H,4-5,9H2,(H,17,19)/p+1