ethyl (4R,5R)-3-azanyl-2-(3-ethoxy-3-oxidanylidene-propanoyl)-6-methylidene-4-thiophen-2-yl-5,7-dihydro-4H-thieno[2,3-b]pyridine-5-carboxylate

Systemtic Name: ethyl (4R,5R)-3-azanyl-2-(3-ethoxy-3-oxidanylidene-propanoyl)-6-methylidene-4-thiophen-2-yl-5,7-dihydro-4H-thieno[2,3-b]pyridine-5-carboxylate Openeye Name: ethyl (4R,5R)-3-amino-2-(3-ethoxy-3-oxo-propanoyl)-6-methylene-4-(2-thienyl)-5,7-dihydro-4H-thieno[2,3-b]pyridine-5-carboxylate CAS Name: (4R,5R)-3-amino-2-(3-ethoxy-1,3-dioxopropyl)-6-methylene-4-thiophen-2-yl-5,7-dihydro-4H-thieno[2,3-b]pyridine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4R,5R)-3-amino-2-(3-ethoxy-3-oxopropanoyl)-6-methylidene-4-thiophen-2-yl-5,7-dihydro-4H-thieno[2,3-b]pyridine-5-carboxylate Traditional Name: (4R,5R)-3-amino-2-(3-ethoxy-3-keto-propanoyl)-6-methylene-4-(2-thienyl)-5,7-dihydro-4H-thieno[2,3-b]pyridine-5-carboxylic acid ethyl ester Formula: C20H22N2O5S2 MolecularWeight: 434.52908

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)C1=C(C2=C(S1)NC(=C)C(C2C3=CC=CS3)C(=O)OCC)N

Isomeric SMILES

CCOC(=O)CC(=O)C1=C(C2=C(S1)NC(=C)[C@@H]([C@H]2C3=CC=CS3)C(=O)OCC)N

InChI

InChI=1S/C20H22N2O5S2/c1-4-26-13(24)9-11(23)18-17(21)16-15(12-7-6-8-28-12)14(20(25)27-5-2)10(3)22-19(16)29-18/h6-8,14-15,22H,3-5,9,21H2,1-2H3/t14-,15+/m0/s1