3-bromanyl-N-[[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-N-[[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamothioyl]benzamide Openeye Name: 3-bromo-N-[[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamothioyl]benzamide CAS Name: 3-bromo-N-[[4-[(6,7-dimethoxy-4-quinazolinyl)oxy]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-N-[[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamothioyl]benzamide Traditional Name: 3-bromo-N-[[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]thiocarbamoyl]benzamide Formula: C24H19BrN4O4S MolecularWeight: 539.40106

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)OC3=CC=C(C=C3)NC(=S)NC(=O)C4=CC(=CC=C4)Br)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)OC3=CC=C(C=C3)NC(=S)NC(=O)C4=CC(=CC=C4)Br)OC

InChI

InChI=1S/C24H19BrN4O4S/c1-31-20-11-18-19(12-21(20)32-2)26-13-27-23(18)33-17-8-6-16(7-9-17)28-24(34)29-22(30)14-4-3-5-15(25)10-14/h3-13H,1-2H3,(H2,28,29,30,34)