[(3S)-2-oxidanylideneoxolan-3-yl] 4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: [(3S)-2-oxidanylideneoxolan-3-yl] 4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridine-2-carboxylate Openeye Name: [(3S)-2-oxotetrahydrofuran-3-yl] 4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridine-2-carboxylate CAS Name: 4,6-dimethyl-3-(1-pyrrolyl)-2-thieno[2,3-b]pyridinecarboxylic acid [(3S)-2-oxo-3-oxolanyl] ester IUPAC Name: [(3S)-2-oxooxolan-3-yl] 4,6-dimethyl-3-pyrrol-1-ylthieno[2,3-b]pyridine-2-carboxylate Traditional Name: 4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridine-2-carboxylic acid [(3S)-2-ketotetrahydrofuran-3-yl] ester Formula: C18H16N2O4S MolecularWeight: 356.39564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C(=C(S2)C(=O)OC3CCOC3=O)N4C=CC=C4)C

Isomeric SMILES

CC1=CC(=NC2=C1C(=C(S2)C(=O)O[C@H]3CCOC3=O)N4C=CC=C4)C

InChI

InChI=1S/C18H16N2O4S/c1-10-9-11(2)19-16-13(10)14(20-6-3-4-7-20)15(25-16)18(22)24-12-5-8-23-17(12)21/h3-4,6-7,9,12H,5,8H2,1-2H3/t12-/m0/s1