2-methylpropyl 2-azanyl-3-(3,4,5-trimethoxyphenyl)carbonyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate

Systemtic Name: 2-methylpropyl 2-azanyl-3-(3,4,5-trimethoxyphenyl)carbonyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Openeye Name: isobutyl 2-amino-3-(3,4,5-trimethoxybenzoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate CAS Name: 2-amino-3-[oxo-(3,4,5-trimethoxyphenyl)methyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-amino-3-(3,4,5-trimethoxybenzoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Traditional Name: 2-amino-3-(3,4,5-trimethoxybenzoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid isobutyl ester Formula: C22H28N2O6S MolecularWeight: 448.53252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)N1CCC2=C(C1)SC(=C2C(=O)C3=CC(=C(C(=C3)OC)OC)OC)N

Isomeric SMILES

CC(C)COC(=O)N1CCC2=C(C1)SC(=C2C(=O)C3=CC(=C(C(=C3)OC)OC)OC)N

InChI

InChI=1S/C22H28N2O6S/c1-12(2)11-30-22(26)24-7-6-14-17(10-24)31-21(23)18(14)19(25)13-8-15(27-3)20(29-5)16(9-13)28-4/h8-9,12H,6-7,10-11,23H2,1-5H3