N-(pyridin-1-ium-3-ylmethyl)-3-thiophen-2-yl-prop-2-enamide

Systemtic Name: N-(pyridin-1-ium-3-ylmethyl)-3-thiophen-2-yl-prop-2-enamide Openeye Name: N-(pyridin-1-ium-3-ylmethyl)-3-(2-thienyl)prop-2-enamide CAS Name: N-(3-pyridin-1-iumylmethyl)-3-thiophen-2-yl-2-propenamide IUPAC Name: N-(pyridin-1-ium-3-ylmethyl)-3-thiophen-2-ylprop-2-enamide Traditional Name: N-(pyridin-1-ium-3-ylmethyl)-3-(2-thienyl)acrylamide Formula: C13H13N2OS+ MolecularWeight: 245.32012

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C[NH+]=C1)CNC(=O)C=CC2=CC=CS2

Isomeric SMILES

C1=CC(=C[NH+]=C1)CNC(=O)C=CC2=CC=CS2

InChI

InChI=1S/C13H12N2OS/c16-13(6-5-12-4-2-8-17-12)15-10-11-3-1-7-14-9-11/h1-9H,10H2,(H,15,16)/p+1