N-[(6,7-dimethoxyquinolin-4-yl)oxy-(2-fluorophenyl)carbamothioyl]-3-methoxy-benzamide

Systemtic Name: N-[(6,7-dimethoxyquinolin-4-yl)oxy-(2-fluorophenyl)carbamothioyl]-3-methoxy-benzamide Openeye Name: N-[(6,7-dimethoxy-4-quinolyl)oxy-(2-fluorophenyl)carbamothioyl]-3-methoxy-benzamide CAS Name: N-[[N-[(6,7-dimethoxy-4-quinolinyl)oxy]-2-fluoroanilino]-sulfanylidenemethyl]-3-methoxybenzamide IUPAC Name: N-[(6,7-dimethoxyquinolin-4-yl)oxy-(2-fluorophenyl)carbamothioyl]-3-methoxybenzamide Traditional Name: N-[(6,7-dimethoxy-4-quinolyl)oxy-(2-fluorophenyl)thiocarbamoyl]-3-methoxy-benzamide Formula: C26H22FN3O5S MolecularWeight: 507.533383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)NC(=S)N(C2=CC=CC=C2F)OC3=C4C=C(C(=CC4=NC=C3)OC)OC

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)NC(=S)N(C2=CC=CC=C2F)OC3=C4C=C(C(=CC4=NC=C3)OC)OC

InChI

InChI=1S/C26H22FN3O5S/c1-32-17-8-6-7-16(13-17)25(31)29-26(36)30(21-10-5-4-9-19(21)27)35-22-11-12-28-20-15-24(34-3)23(33-2)14-18(20)22/h4-15H,1-3H3,(H,29,31,36)