N-isoquinolin-3-yl-3-[(7-methoxyquinolin-4-yl)methylamino]thiophene-2-carboxamide

Systemtic Name: N-isoquinolin-3-yl-3-[(7-methoxyquinolin-4-yl)methylamino]thiophene-2-carboxamide Openeye Name: N-(3-isoquinolyl)-3-[(7-methoxy-4-quinolyl)methylamino]thiophene-2-carboxamide CAS Name: N-(3-isoquinolinyl)-3-[(7-methoxy-4-quinolinyl)methylamino]-2-thiophenecarboxamide IUPAC Name: N-isoquinolin-3-yl-3-[(7-methoxyquinolin-4-yl)methylamino]thiophene-2-carboxamide Traditional Name: N-(3-isoquinolyl)-3-[(7-methoxy-4-quinolyl)methylamino]thiophene-2-carboxamide Formula: C25H20N4O2S MolecularWeight: 440.5169

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=NC=CC(=C2C=C1)CNC3=C(SC=C3)C(=O)NC4=CC5=CC=CC=C5C=N4

Isomeric SMILES

COC1=CC2=NC=CC(=C2C=C1)CNC3=C(SC=C3)C(=O)NC4=CC5=CC=CC=C5C=N4

InChI

InChI=1S/C25H20N4O2S/c1-31-19-6-7-20-18(8-10-26-22(20)13-19)15-27-21-9-11-32-24(21)25(30)29-23-12-16-4-2-3-5-17(16)14-28-23/h2-14,27H,15H2,1H3,(H,28,29,30)