3-[1-(6,7-dimethoxyisoquinolin-4-yl)-2-oxidanylidene-2-(3-propan-2-yloxyphenyl)ethyl]-1,3-thiazolidine-2,4-dione

Systemtic Name: 3-[1-(6,7-dimethoxyisoquinolin-4-yl)-2-oxidanylidene-2-(3-propan-2-yloxyphenyl)ethyl]-1,3-thiazolidine-2,4-dione Openeye Name: 3-[1-(6,7-dimethoxy-4-isoquinolyl)-2-(3-isopropoxyphenyl)-2-oxo-ethyl]thiazolidine-2,4-dione CAS Name: 3-[1-(6,7-dimethoxy-4-isoquinolinyl)-2-oxo-2-(3-propan-2-yloxyphenyl)ethyl]thiazolidine-2,4-dione IUPAC Name: 3-[1-(6,7-dimethoxyisoquinolin-4-yl)-2-oxo-2-(3-propan-2-yloxyphenyl)ethyl]-1,3-thiazolidine-2,4-dione Traditional Name: 3-[1-(6,7-dimethoxy-4-isoquinolyl)-2-(3-isopropoxyphenyl)-2-keto-ethyl]thiazolidine-2,4-quinone Formula: C25H24N2O6S MolecularWeight: 480.53286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)C(=O)C(C2=CN=CC3=CC(=C(C=C32)OC)OC)N4C(=O)CSC4=O

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)C(=O)C(C2=CN=CC3=CC(=C(C=C32)OC)OC)N4C(=O)CSC4=O

InChI

InChI=1S/C25H24N2O6S/c1-14(2)33-17-7-5-6-15(8-17)24(29)23(27-22(28)13-34-25(27)30)19-12-26-11-16-9-20(31-3)21(32-4)10-18(16)19/h5-12,14,23H,13H2,1-4H3