N-[2-(6,7-dimethoxyisoquinolin-1-yl)carbonyl-4,5-dimethoxy-phenyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: N-[2-(6,7-dimethoxyisoquinolin-1-yl)carbonyl-4,5-dimethoxy-phenyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-[2-(6,7-dimethoxyisoquinoline-1-carbonyl)-4,5-dimethoxy-phenyl]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N-[2-[(6,7-dimethoxy-1-isoquinolinyl)-oxomethyl]-4,5-dimethoxyphenyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-[2-(6,7-dimethoxyisoquinoline-1-carbonyl)-4,5-dimethoxyphenyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-[2-(6,7-dimethoxyisoquinoline-1-carbonyl)-4,5-dimethoxy-phenyl]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C29H28N2O6S MolecularWeight: 532.60742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C=CN=C2C(=O)C3=CC(=C(C=C3NC(=O)C4=CSC5=C4CCCC5)OC)OC)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C=CN=C2C(=O)C3=CC(=C(C=C3NC(=O)C4=CSC5=C4CCCC5)OC)OC)OC

InChI

InChI=1S/C29H28N2O6S/c1-34-22-11-16-9-10-30-27(18(16)12-23(22)35-2)28(32)19-13-24(36-3)25(37-4)14-21(19)31-29(33)20-15-38-26-8-6-5-7-17(20)26/h9-15H,5-8H2,1-4H3,(H,31,33)