N-[[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamothioyl]dodecanamide

Systemtic Name: N-[[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamothioyl]dodecanamide Openeye Name: N-[[4-[(6,7-dimethoxy-4-quinolyl)oxy]phenyl]carbamothioyl]dodecanamide CAS Name: N-[[4-[(6,7-dimethoxy-4-quinolinyl)oxy]anilino]-sulfanylidenemethyl]dodecanamide IUPAC Name: N-[[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamothioyl]dodecanamide Traditional Name: N-[[4-[(6,7-dimethoxy-4-quinolyl)oxy]phenyl]thiocarbamoyl]lauramide Formula: C30H39N3O4S MolecularWeight: 537.71336

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H39N3O4S/c1-4-5-6-7-8-9-10-11-12-13-29(34)33-30(38)32-22-14-16-23(17-15-22)37-26-18-19-31-25-21-28(36-3)27(35-2)20-24(25)26/h14-21H,4-13H2,1-3H3,(H2,32,33,34,38)