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

Systemtic Name: N-[(6,7-dimethoxyquinolin-4-yl)oxy-(2-fluorophenyl)carbamothioyl]-4-ethyl-benzamide Openeye Name: N-[(6,7-dimethoxy-4-quinolyl)oxy-(2-fluorophenyl)carbamothioyl]-4-ethyl-benzamide CAS Name: N-[[N-[(6,7-dimethoxy-4-quinolinyl)oxy]-2-fluoroanilino]-sulfanylidenemethyl]-4-ethylbenzamide IUPAC Name: N-[(6,7-dimethoxyquinolin-4-yl)oxy-(2-fluorophenyl)carbamothioyl]-4-ethylbenzamide Traditional Name: N-[(6,7-dimethoxy-4-quinolyl)oxy-(2-fluorophenyl)thiocarbamoyl]-4-ethyl-benzamide Formula: C27H24FN3O4S MolecularWeight: 505.560563

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)NC(=S)N(C2=CC=CC=C2F)OC3=C4C=C(C(=CC4=NC=C3)OC)OC

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)NC(=S)N(C2=CC=CC=C2F)OC3=C4C=C(C(=CC4=NC=C3)OC)OC

InChI

InChI=1S/C27H24FN3O4S/c1-4-17-9-11-18(12-10-17)26(32)30-27(36)31(22-8-6-5-7-20(22)28)35-23-13-14-29-21-16-25(34-3)24(33-2)15-19(21)23/h5-16H,4H2,1-3H3,(H,30,32,36)