ethyl 7-butoxy-5-(2,2-dimethylpropyl)-4-oxidanylidene-thieno[3,2-c]pyridine-6-carboxylate

Systemtic Name: ethyl 7-butoxy-5-(2,2-dimethylpropyl)-4-oxidanylidene-thieno[3,2-c]pyridine-6-carboxylate Openeye Name: ethyl 7-butoxy-5-(2,2-dimethylpropyl)-4-oxo-thieno[3,2-c]pyridine-6-carboxylate CAS Name: 7-butoxy-5-(2,2-dimethylpropyl)-4-oxo-6-thieno[3,2-c]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 7-butoxy-5-(2,2-dimethylpropyl)-4-oxothieno[3,2-c]pyridine-6-carboxylate Traditional Name: 7-butoxy-4-keto-5-neopentyl-thieno[3,2-c]pyridine-6-carboxylic acid ethyl ester Formula: C19H27NO4S MolecularWeight: 365.48698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(N(C(=O)C2=C1SC=C2)CC(C)(C)C)C(=O)OCC

Isomeric SMILES

CCCCOC1=C(N(C(=O)C2=C1SC=C2)CC(C)(C)C)C(=O)OCC

InChI

InChI=1S/C19H27NO4S/c1-6-8-10-24-15-14(18(22)23-7-2)20(12-19(3,4)5)17(21)13-9-11-25-16(13)15/h9,11H,6-8,10,12H2,1-5H3