ethyl 2-[2-(5-ethyl-2-methyl-pyridin-1-ium-1-yl)ethanoylamino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(5-ethyl-2-methyl-pyridin-1-ium-1-yl)ethanoylamino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(5-ethyl-2-methyl-pyridin-1-ium-1-yl)acetyl]amino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylate CAS Name: 2-[[2-(5-ethyl-2-methyl-1-pyridin-1-iumyl)-1-oxoethyl]amino]-4-methyl-5-(methylcarbamoyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(5-ethyl-2-methylpyridin-1-ium-1-yl)acetyl]amino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylate Traditional Name: 2-[[2-(5-ethyl-2-methyl-pyridin-1-ium-1-yl)acetyl]amino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylic acid ethyl ester Formula: C20H26N3O4S+ MolecularWeight: 404.50314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C[N+](=C(C=C1)C)CC(=O)NC2=C(C(=C(S2)C(=O)NC)C)C(=O)OCC

Isomeric SMILES

CCC1=C[N+](=C(C=C1)C)CC(=O)NC2=C(C(=C(S2)C(=O)NC)C)C(=O)OCC

InChI

InChI=1S/C20H25N3O4S/c1-6-14-9-8-12(3)23(10-14)11-15(24)22-19-16(20(26)27-7-2)13(4)17(28-19)18(25)21-5/h8-10H,6-7,11H2,1-5H3,(H-,21,22,24,25,26)/p+1