methyl 3-(3-pyridin-2-ylsulfanylpropanoylamino)thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: methyl 3-(3-pyridin-2-ylsulfanylpropanoylamino)thieno[2,3-b]pyridine-2-carboxylate Openeye Name: methyl 3-[3-(2-pyridylsulfanyl)propanoylamino]thieno[2,3-b]pyridine-2-carboxylate CAS Name: 3-[[1-oxo-3-(2-pyridinylthio)propyl]amino]-2-thieno[2,3-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 3-(3-pyridin-2-ylsulfanylpropanoylamino)thieno[2,3-b]pyridine-2-carboxylate Traditional Name: 3-[3-(2-pyridylthio)propanoylamino]thieno[2,3-b]pyridine-2-carboxylic acid methyl ester Formula: C17H15N3O3S2 MolecularWeight: 373.4493

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=C(S1)N=CC=C2)NC(=O)CCSC3=CC=CC=N3

Isomeric SMILES

COC(=O)C1=C(C2=C(S1)N=CC=C2)NC(=O)CCSC3=CC=CC=N3

InChI

InChI=1S/C17H15N3O3S2/c1-23-17(22)15-14(11-5-4-9-19-16(11)25-15)20-12(21)7-10-24-13-6-2-3-8-18-13/h2-6,8-9H,7,10H2,1H3,(H,20,21)