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

Systemtic Name: N-[[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamothioyl]-2,2-dimethyl-propanamide Openeye Name: N-[[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamothioyl]-2,2-dimethyl-propanamide CAS Name: N-[[4-[(6,7-dimethoxy-4-quinazolinyl)oxy]anilino]-sulfanylidenemethyl]-2,2-dimethylpropanamide IUPAC Name: N-[[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamothioyl]-2,2-dimethylpropanamide Traditional Name: N-[[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]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)NC1=CC=C(C=C1)OC2=NC=NC3=CC(=C(C=C32)OC)OC

Isomeric SMILES

CC(C)(C)C(=O)NC(=S)NC1=CC=C(C=C1)OC2=NC=NC3=CC(=C(C=C32)OC)OC

InChI

InChI=1S/C22H24N4O4S/c1-22(2,3)20(27)26-21(31)25-13-6-8-14(9-7-13)30-19-15-10-17(28-4)18(29-5)11-16(15)23-12-24-19/h6-12H,1-5H3,(H2,25,26,27,31)