N-[[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamothioyl]-2-naphthalen-2-yl-ethanamide

Systemtic Name: N-[[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamothioyl]-2-naphthalen-2-yl-ethanamide Openeye Name: N-[[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamothioyl]-2-(2-naphthyl)acetamide CAS Name: N-[[4-[(6,7-dimethoxy-4-quinazolinyl)oxy]anilino]-sulfanylidenemethyl]-2-(2-naphthalenyl)acetamide IUPAC Name: N-[[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamothioyl]-2-naphthalen-2-ylacetamide Traditional Name: N-[[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]thiocarbamoyl]-2-(2-naphthyl)acetamide Formula: C29H24N4O4S MolecularWeight: 524.59026

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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)CC4=CC5=CC=CC=C5C=C4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)OC3=CC=C(C=C3)NC(=S)NC(=O)CC4=CC5=CC=CC=C5C=C4)OC

InChI

InChI=1S/C29H24N4O4S/c1-35-25-15-23-24(16-26(25)36-2)30-17-31-28(23)37-22-11-9-21(10-12-22)32-29(38)33-27(34)14-18-7-8-19-5-3-4-6-20(19)13-18/h3-13,15-17H,14H2,1-2H3,(H2,32,33,34,38)