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

Systemtic Name: N-[[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-methyl-phenyl]carbamothioyl]-2-methyl-benzamide Openeye Name: N-[[4-[(6,7-dimethoxy-4-quinolyl)oxy]-2-methyl-phenyl]carbamothioyl]-2-methyl-benzamide CAS Name: N-[[4-[(6,7-dimethoxy-4-quinolinyl)oxy]-2-methylanilino]-sulfanylidenemethyl]-2-methylbenzamide IUPAC Name: N-[[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-methylphenyl]carbamothioyl]-2-methylbenzamide Traditional Name: N-[[4-[(6,7-dimethoxy-4-quinolyl)oxy]-2-methyl-phenyl]thiocarbamoyl]-2-methyl-benzamide Formula: C27H25N3O4S MolecularWeight: 487.5701

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC(=S)NC2=C(C=C(C=C2)OC3=C4C=C(C(=CC4=NC=C3)OC)OC)C

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC(=S)NC2=C(C=C(C=C2)OC3=C4C=C(C(=CC4=NC=C3)OC)OC)C

InChI

InChI=1S/C27H25N3O4S/c1-16-7-5-6-8-19(16)26(31)30-27(35)29-21-10-9-18(13-17(21)2)34-23-11-12-28-22-15-25(33-4)24(32-3)14-20(22)23/h5-15H,1-4H3,(H2,29,30,31,35)