ethyl 4-ethyl-5-methyl-2-(2-pyridin-2-ylsulfanylpropanoylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 4-ethyl-5-methyl-2-(2-pyridin-2-ylsulfanylpropanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 4-ethyl-5-methyl-2-[2-(2-pyridylsulfanyl)propanoylamino]thiophene-3-carboxylate CAS Name: 4-ethyl-5-methyl-2-[[1-oxo-2-(2-pyridinylthio)propyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-ethyl-5-methyl-2-(2-pyridin-2-ylsulfanylpropanoylamino)thiophene-3-carboxylate Traditional Name: 4-ethyl-5-methyl-2-[2-(2-pyridylthio)propanoylamino]thiophene-3-carboxylic acid ethyl ester Formula: C18H22N2O3S2 MolecularWeight: 378.50888

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OCC)NC(=O)C(C)SC2=CC=CC=N2)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OCC)NC(=O)C(C)SC2=CC=CC=N2)C

InChI

InChI=1S/C18H22N2O3S2/c1-5-13-11(3)25-17(15(13)18(22)23-6-2)20-16(21)12(4)24-14-9-7-8-10-19-14/h7-10,12H,5-6H2,1-4H3,(H,20,21)