N-[[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-fluoranyl-phenyl]carbamothioyl]dodecanamide

Systemtic Name: N-[[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-fluoranyl-phenyl]carbamothioyl]dodecanamide Openeye Name: N-[[4-[(6,7-dimethoxy-4-quinolyl)oxy]-2-fluoro-phenyl]carbamothioyl]dodecanamide CAS Name: N-[[4-[(6,7-dimethoxy-4-quinolinyl)oxy]-2-fluoroanilino]-sulfanylidenemethyl]dodecanamide IUPAC Name: N-[[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-fluorophenyl]carbamothioyl]dodecanamide Traditional Name: N-[[4-[(6,7-dimethoxy-4-quinolyl)oxy]-2-fluoro-phenyl]thiocarbamoyl]lauramide Formula: C30H38FN3O4S MolecularWeight: 555.703823

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NC(=S)NC1=C(C=C(C=C1)OC2=C3C=C(C(=CC3=NC=C2)OC)OC)F

Isomeric SMILES

CCCCCCCCCCCC(=O)NC(=S)NC1=C(C=C(C=C1)OC2=C3C=C(C(=CC3=NC=C2)OC)OC)F

InChI

InChI=1S/C30H38FN3O4S/c1-4-5-6-7-8-9-10-11-12-13-29(35)34-30(39)33-24-15-14-21(18-23(24)31)38-26-16-17-32-25-20-28(37-3)27(36-2)19-22(25)26/h14-20H,4-13H2,1-3H3,(H2,33,34,35,39)