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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC(=S)N(C2=CC=CC=C2F)OC3=C4C=C(C(=CC4=NC=C3)OC)OC

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC(=S)N(C2=CC=CC=C2F)OC3=C4C=C(C(=CC4=NC=C3)OC)OC

InChI

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