N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2-[4-(phenylcarbonyl)pyridin-1-ium-1-yl]ethanamide

Systemtic Name: N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2-[4-(phenylcarbonyl)pyridin-1-ium-1-yl]ethanamide Openeye Name: 2-(4-benzoylpyridin-1-ium-1-yl)-N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)acetamide CAS Name: 2-(4-benzoyl-1-pyridin-1-iumyl)-N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)acetamide IUPAC Name: 2-(4-benzoylpyridin-1-ium-1-yl)-N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)acetamide Traditional Name: 2-(4-benzoylpyridin-1-ium-1-yl)-N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)acetamide Formula: C22H18N3O2S+ MolecularWeight: 388.46222

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)SC(=C2C#N)NC(=O)C[N+]3=CC=C(C=C3)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CC2=C(C1)SC(=C2C#N)NC(=O)C[N+]3=CC=C(C=C3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H17N3O2S/c23-13-18-17-7-4-8-19(17)28-22(18)24-20(26)14-25-11-9-16(10-12-25)21(27)15-5-2-1-3-6-15/h1-3,5-6,9-12H,4,7-8,14H2/p+1