4-(chloromethyl)-N-[[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamothioyl]benzamide

Systemtic Name: 4-(chloromethyl)-N-[[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamothioyl]benzamide Openeye Name: 4-(chloromethyl)-N-[[4-[(6,7-dimethoxy-4-quinolyl)oxy]phenyl]carbamothioyl]benzamide CAS Name: 4-(chloromethyl)-N-[[4-[(6,7-dimethoxy-4-quinolinyl)oxy]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-(chloromethyl)-N-[[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamothioyl]benzamide Traditional Name: 4-(chloromethyl)-N-[[4-[(6,7-dimethoxy-4-quinolyl)oxy]phenyl]thiocarbamoyl]benzamide Formula: C26H22ClN3O4S MolecularWeight: 507.98858

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=CN=C2C=C1OC)OC3=CC=C(C=C3)NC(=S)NC(=O)C4=CC=C(C=C4)CCl

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1OC)OC3=CC=C(C=C3)NC(=S)NC(=O)C4=CC=C(C=C4)CCl

InChI

InChI=1S/C26H22ClN3O4S/c1-32-23-13-20-21(14-24(23)33-2)28-12-11-22(20)34-19-9-7-18(8-10-19)29-26(35)30-25(31)17-5-3-16(15-27)4-6-17/h3-14H,15H2,1-2H3,(H2,29,30,31,35)