4-[[7-methyl-4-oxidanylidene-2-[(phenylmethyl)carbamoyl]thieno[2,3-b]pyridin-5-yl]methyl]benzoic acid

Systemtic Name: 4-[[7-methyl-4-oxidanylidene-2-[(phenylmethyl)carbamoyl]thieno[2,3-b]pyridin-5-yl]methyl]benzoic acid Openeye Name: 4-[[2-(benzylcarbamoyl)-7-methyl-4-oxo-thieno[2,3-b]pyridin-5-yl]methyl]benzoic acid CAS Name: 4-[[7-methyl-4-oxo-2-[oxo-[(phenylmethyl)amino]methyl]-5-thieno[2,3-b]pyridinyl]methyl]benzoic acid IUPAC Name: 4-[[2-(benzylcarbamoyl)-7-methyl-4-oxothieno[2,3-b]pyridin-5-yl]methyl]benzoic acid Traditional Name: 4-[[2-(benzylcarbamoyl)-4-keto-7-methyl-thieno[2,3-b]pyridin-5-yl]methyl]benzoic acid Formula: C24H20N2O4S MolecularWeight: 432.4916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)C2=C1SC(=C2)C(=O)NCC3=CC=CC=C3)CC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

CN1C=C(C(=O)C2=C1SC(=C2)C(=O)NCC3=CC=CC=C3)CC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C24H20N2O4S/c1-26-14-18(11-15-7-9-17(10-8-15)24(29)30)21(27)19-12-20(31-23(19)26)22(28)25-13-16-5-3-2-4-6-16/h2-10,12,14H,11,13H2,1H3,(H,25,28)(H,29,30)