N-[[3-(isoquinolin-3-ylmethoxy)phenyl]carbamothioyl]furo[3,2-c]pyridine-2-carboxamide

Systemtic Name: N-[[3-(isoquinolin-3-ylmethoxy)phenyl]carbamothioyl]furo[3,2-c]pyridine-2-carboxamide Openeye Name: N-[[3-(3-isoquinolylmethoxy)phenyl]carbamothioyl]furo[3,2-c]pyridine-2-carboxamide CAS Name: N-[[3-(3-isoquinolinylmethoxy)anilino]-sulfanylidenemethyl]-2-furo[3,2-c]pyridinecarboxamide IUPAC Name: N-[[3-(isoquinolin-3-ylmethoxy)phenyl]carbamothioyl]furo[3,2-c]pyridine-2-carboxamide Traditional Name: N-[[3-(3-isoquinolylmethoxy)phenyl]thiocarbamoyl]furo[3,2-c]pyridine-2-carboxamide Formula: C25H18N4O3S MolecularWeight: 454.50042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=NC(=CC2=C1)COC3=CC=CC(=C3)NC(=S)NC(=O)C4=CC5=C(O4)C=CN=C5

Isomeric SMILES

C1=CC=C2C=NC(=CC2=C1)COC3=CC=CC(=C3)NC(=S)NC(=O)C4=CC5=C(O4)C=CN=C5

InChI

InChI=1S/C25H18N4O3S/c30-24(23-11-18-13-26-9-8-22(18)32-23)29-25(33)28-19-6-3-7-21(12-19)31-15-20-10-16-4-1-2-5-17(16)14-27-20/h1-14H,15H2,(H2,28,29,30,33)