3-cyclopentyl-N-[[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamothioyl]propanamide

Systemtic Name: 3-cyclopentyl-N-[[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamothioyl]propanamide Openeye Name: 3-cyclopentyl-N-[[4-[(6,7-dimethoxy-4-quinolyl)oxy]phenyl]carbamothioyl]propanamide CAS Name: 3-cyclopentyl-N-[[4-[(6,7-dimethoxy-4-quinolinyl)oxy]anilino]-sulfanylidenemethyl]propanamide IUPAC Name: 3-cyclopentyl-N-[[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamothioyl]propanamide Traditional Name: 3-cyclopentyl-N-[[4-[(6,7-dimethoxy-4-quinolyl)oxy]phenyl]thiocarbamoyl]propionamide Formula: C26H29N3O4S MolecularWeight: 479.59116

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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)CCC4CCCC4

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1OC)OC3=CC=C(C=C3)NC(=S)NC(=O)CCC4CCCC4

InChI

InChI=1S/C26H29N3O4S/c1-31-23-15-20-21(16-24(23)32-2)27-14-13-22(20)33-19-10-8-18(9-11-19)28-26(34)29-25(30)12-7-17-5-3-4-6-17/h8-11,13-17H,3-7,12H2,1-2H3,(H2,28,29,30,34)