N-[[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamothioyl]-2-(2-nitrophenyl)ethanamide

Systemtic Name: N-[[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamothioyl]-2-(2-nitrophenyl)ethanamide Openeye Name: N-[[4-[(6,7-dimethoxy-4-quinolyl)oxy]phenyl]carbamothioyl]-2-(2-nitrophenyl)acetamide CAS Name: N-[[4-[(6,7-dimethoxy-4-quinolinyl)oxy]anilino]-sulfanylidenemethyl]-2-(2-nitrophenyl)acetamide IUPAC Name: N-[[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamothioyl]-2-(2-nitrophenyl)acetamide Traditional Name: N-[[4-[(6,7-dimethoxy-4-quinolyl)oxy]phenyl]thiocarbamoyl]-2-(2-nitrophenyl)acetamide Formula: C26H22N4O6S MolecularWeight: 518.54108

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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)CC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1OC)OC3=CC=C(C=C3)NC(=S)NC(=O)CC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C26H22N4O6S/c1-34-23-14-19-20(15-24(23)35-2)27-12-11-22(19)36-18-9-7-17(8-10-18)28-26(37)29-25(31)13-16-5-3-4-6-21(16)30(32)33/h3-12,14-15H,13H2,1-2H3,(H2,28,29,31,37)