N-[(6,7-dimethoxyquinazolin-4-yl)oxy-(2-morpholin-4-ylphenyl)carbamothioyl]-2-methyl-benzamide

Systemtic Name: N-[(6,7-dimethoxyquinazolin-4-yl)oxy-(2-morpholin-4-ylphenyl)carbamothioyl]-2-methyl-benzamide Openeye Name: N-[(6,7-dimethoxyquinazolin-4-yl)oxy-(2-morpholinophenyl)carbamothioyl]-2-methyl-benzamide CAS Name: N-[[N-[(6,7-dimethoxy-4-quinazolinyl)oxy]-2-(4-morpholinyl)anilino]-sulfanylidenemethyl]-2-methylbenzamide IUPAC Name: N-[(6,7-dimethoxyquinazolin-4-yl)oxy-(2-morpholin-4-ylphenyl)carbamothioyl]-2-methylbenzamide Traditional Name: N-[(6,7-dimethoxyquinazolin-4-yl)oxy-(2-morpholinophenyl)thiocarbamoyl]-2-methyl-benzamide Formula: C29H29N5O5S MolecularWeight: 559.63606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC(=S)N(C2=CC=CC=C2N3CCOCC3)OC4=NC=NC5=CC(=C(C=C54)OC)OC

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC(=S)N(C2=CC=CC=C2N3CCOCC3)OC4=NC=NC5=CC(=C(C=C54)OC)OC

InChI

InChI=1S/C29H29N5O5S/c1-19-8-4-5-9-20(19)27(35)32-29(40)34(24-11-7-6-10-23(24)33-12-14-38-15-13-33)39-28-21-16-25(36-2)26(37-3)17-22(21)30-18-31-28/h4-11,16-18H,12-15H2,1-3H3,(H,32,35,40)