N-[(6,7-dimethoxyquinazolin-4-yl)oxy-phenyl-carbamothioyl]-2,2-dimethyl-propanamide

Systemtic Name: N-[(6,7-dimethoxyquinazolin-4-yl)oxy-phenyl-carbamothioyl]-2,2-dimethyl-propanamide Openeye Name: N-[(6,7-dimethoxyquinazolin-4-yl)oxy-phenyl-carbamothioyl]-2,2-dimethyl-propanamide CAS Name: N-[[N-[(6,7-dimethoxy-4-quinazolinyl)oxy]anilino]-sulfanylidenemethyl]-2,2-dimethylpropanamide IUPAC Name: N-[(6,7-dimethoxyquinazolin-4-yl)oxy-phenylcarbamothioyl]-2,2-dimethylpropanamide Traditional Name: N-[(6,7-dimethoxyquinazolin-4-yl)oxy-phenyl-thiocarbamoyl]-2,2-dimethyl-propionamide Formula: C22H24N4O4S MolecularWeight: 440.51536

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC(=S)N(C1=CC=CC=C1)OC2=NC=NC3=CC(=C(C=C32)OC)OC

Isomeric SMILES

CC(C)(C)C(=O)NC(=S)N(C1=CC=CC=C1)OC2=NC=NC3=CC(=C(C=C32)OC)OC

InChI

InChI=1S/C22H24N4O4S/c1-22(2,3)20(27)25-21(31)26(14-9-7-6-8-10-14)30-19-15-11-17(28-4)18(29-5)12-16(15)23-13-24-19/h6-13H,1-5H3,(H,25,27,31)