N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(5-ethyl-2-methyl-pyridin-1-ium-1-yl)ethanamide

Systemtic Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(5-ethyl-2-methyl-pyridin-1-ium-1-yl)ethanamide Openeye Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-(5-ethyl-2-methyl-pyridin-1-ium-1-yl)acetamide CAS Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(5-ethyl-2-methyl-1-pyridin-1-iumyl)acetamide IUPAC Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(5-ethyl-2-methylpyridin-1-ium-1-yl)acetamide Traditional Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-(5-ethyl-2-methyl-pyridin-1-ium-1-yl)acetamide Formula: C19H22N3OS+ MolecularWeight: 340.46248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C[N+](=C(C=C1)C)CC(=O)NC2=C(C3=C(S2)CCCC3)C#N

Isomeric SMILES

CCC1=C[N+](=C(C=C1)C)CC(=O)NC2=C(C3=C(S2)CCCC3)C#N

InChI

InChI=1S/C19H21N3OS/c1-3-14-9-8-13(2)22(11-14)12-18(23)21-19-16(10-20)15-6-4-5-7-17(15)24-19/h8-9,11H,3-7,12H2,1-2H3/p+1