tert-butyl 7-(1,3-dithian-2-ylidenemethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate

Systemtic Name: tert-butyl 7-(1,3-dithian-2-ylidenemethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Openeye Name: tert-butyl 7-(1,3-dithian-2-ylidenemethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate CAS Name: 7-(1,3-dithian-2-ylidenemethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 7-(1,3-dithian-2-ylidenemethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Traditional Name: 7-(1,3-dithian-2-ylidenemethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid tert-butyl ester Formula: C17H23NO2S3 MolecularWeight: 369.56502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC2=C(C1C=C3SCCCS3)SC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC2=C(C1C=C3SCCCS3)SC=C2

InChI

InChI=1S/C17H23NO2S3/c1-17(2,3)20-16(19)18-7-5-12-6-10-23-15(12)13(18)11-14-21-8-4-9-22-14/h6,10-11,13H,4-5,7-9H2,1-3H3