N-[[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethyl-phenyl]carbamothioyl]-4-methyl-benzamide

Systemtic Name: N-[[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethyl-phenyl]carbamothioyl]-4-methyl-benzamide Openeye Name: N-[[4-[(6,7-dimethoxy-4-quinolyl)oxy]-2,3-dimethyl-phenyl]carbamothioyl]-4-methyl-benzamide CAS Name: N-[[4-[(6,7-dimethoxy-4-quinolinyl)oxy]-2,3-dimethylanilino]-sulfanylidenemethyl]-4-methylbenzamide IUPAC Name: N-[[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,3-dimethylphenyl]carbamothioyl]-4-methylbenzamide Traditional Name: N-[[4-[(6,7-dimethoxy-4-quinolyl)oxy]-2,3-dimethyl-phenyl]thiocarbamoyl]-4-methyl-benzamide Formula: C28H27N3O4S MolecularWeight: 501.59668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(=S)NC2=C(C(=C(C=C2)OC3=C4C=C(C(=CC4=NC=C3)OC)OC)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC(=S)NC2=C(C(=C(C=C2)OC3=C4C=C(C(=CC4=NC=C3)OC)OC)C)C

InChI

InChI=1S/C28H27N3O4S/c1-16-6-8-19(9-7-16)27(32)31-28(36)30-21-10-11-23(18(3)17(21)2)35-24-12-13-29-22-15-26(34-5)25(33-4)14-20(22)24/h6-15H,1-5H3,(H2,30,31,32,36)