(phenylmethyl) 4-(tert-butylcarbamoyl)-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxylate

Systemtic Name: (phenylmethyl) 4-(tert-butylcarbamoyl)-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxylate Openeye Name: benzyl 4-(tert-butylcarbamoyl)-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxylate CAS Name: 4-[(tert-butylamino)-oxomethyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(tert-butylcarbamoyl)-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxylate Traditional Name: 4-(tert-butylcarbamoyl)-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxylic acid benzyl ester Formula: C20H24N2O3S MolecularWeight: 372.48116

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1C2=C(CCN1C(=O)OCC3=CC=CC=C3)SC=C2

Isomeric SMILES

CC(C)(C)NC(=O)C1C2=C(CCN1C(=O)OCC3=CC=CC=C3)SC=C2

InChI

InChI=1S/C20H24N2O3S/c1-20(2,3)21-18(23)17-15-10-12-26-16(15)9-11-22(17)19(24)25-13-14-7-5-4-6-8-14/h4-8,10,12,17H,9,11,13H2,1-3H3,(H,21,23)