methyl 4-[3-azanyl-2-(furan-2-ylcarbonyl)-6-oxidanylidene-5,7-dihydro-4H-thieno[2,3-b]pyridin-4-yl]benzoate

Systemtic Name: methyl 4-[3-azanyl-2-(furan-2-ylcarbonyl)-6-oxidanylidene-5,7-dihydro-4H-thieno[2,3-b]pyridin-4-yl]benzoate Openeye Name: methyl 4-[3-amino-2-(furan-2-carbonyl)-6-oxo-5,7-dihydro-4H-thieno[2,3-b]pyridin-4-yl]benzoate CAS Name: 4-[3-amino-2-[2-furanyl(oxo)methyl]-6-oxo-5,7-dihydro-4H-thieno[2,3-b]pyridin-4-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-amino-2-(furan-2-carbonyl)-6-oxo-5,7-dihydro-4H-thieno[2,3-b]pyridin-4-yl]benzoate Traditional Name: 4-[3-amino-2-(2-furoyl)-6-keto-5,7-dihydro-4H-thieno[2,3-b]pyridin-4-yl]benzoic acid methyl ester Formula: C20H16N2O5S MolecularWeight: 396.41644

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2CC(=O)NC3=C2C(=C(S3)C(=O)C4=CC=CO4)N

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2CC(=O)NC3=C2C(=C(S3)C(=O)C4=CC=CO4)N

InChI

InChI=1S/C20H16N2O5S/c1-26-20(25)11-6-4-10(5-7-11)12-9-14(23)22-19-15(12)16(21)18(28-19)17(24)13-3-2-8-27-13/h2-8,12H,9,21H2,1H3,(H,22,23)