ethyl 4,6-dimethyl-3-(2-pyridin-2-ylsulfanylethanoylamino)thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: ethyl 4,6-dimethyl-3-(2-pyridin-2-ylsulfanylethanoylamino)thieno[2,3-b]pyridine-2-carboxylate Openeye Name: ethyl 4,6-dimethyl-3-[[2-(2-pyridylsulfanyl)acetyl]amino]thieno[2,3-b]pyridine-2-carboxylate CAS Name: 4,6-dimethyl-3-[[1-oxo-2-(2-pyridinylthio)ethyl]amino]-2-thieno[2,3-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 4,6-dimethyl-3-[(2-pyridin-2-ylsulfanylacetyl)amino]thieno[2,3-b]pyridine-2-carboxylate Traditional Name: 4,6-dimethyl-3-[[2-(2-pyridylthio)acetyl]amino]thieno[2,3-b]pyridine-2-carboxylic acid ethyl ester Formula: C19H19N3O3S2 MolecularWeight: 401.50246

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=C(C=C2C)C)NC(=O)CSC3=CC=CC=N3

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=C(C=C2C)C)NC(=O)CSC3=CC=CC=N3

InChI

InChI=1S/C19H19N3O3S2/c1-4-25-19(24)17-16(15-11(2)9-12(3)21-18(15)27-17)22-13(23)10-26-14-7-5-6-8-20-14/h5-9H,4,10H2,1-3H3,(H,22,23)