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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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