ethyl 6-oxidanylidene-3-phenyl-7-(piperidin-4-ylmethyl)thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: ethyl 6-oxidanylidene-3-phenyl-7-(piperidin-4-ylmethyl)thieno[2,3-b]pyridine-2-carboxylate Openeye Name: ethyl 6-oxo-3-phenyl-7-(4-piperidylmethyl)thieno[2,3-b]pyridine-2-carboxylate CAS Name: 6-oxo-3-phenyl-7-(4-piperidinylmethyl)-2-thieno[2,3-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-oxo-3-phenyl-7-(piperidin-4-ylmethyl)thieno[2,3-b]pyridine-2-carboxylate Traditional Name: 6-keto-3-phenyl-7-(4-piperidylmethyl)thieno[2,3-b]pyridine-2-carboxylic acid ethyl ester Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N(C(=O)C=C2)CC3CCNCC3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N(C(=O)C=C2)CC3CCNCC3)C4=CC=CC=C4

InChI

InChI=1S/C22H24N2O3S/c1-2-27-22(26)20-19(16-6-4-3-5-7-16)17-8-9-18(25)24(21(17)28-20)14-15-10-12-23-13-11-15/h3-9,15,23H,2,10-14H2,1H3