N-[(3-chloranyl-4-fluoranyl-phenyl)methyl]-2-[1-(4-methoxyquinolin-2-yl)carbonylpiperidin-4-yl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-[(3-chloranyl-4-fluoranyl-phenyl)methyl]-2-[1-(4-methoxyquinolin-2-yl)carbonylpiperidin-4-yl]-1,3-thiazole-4-carboxamide Openeye Name: N-[(3-chloro-4-fluoro-phenyl)methyl]-2-[1-(4-methoxyquinoline-2-carbonyl)-4-piperidyl]thiazole-4-carboxamide CAS Name: N-[(3-chloro-4-fluorophenyl)methyl]-2-[1-[(4-methoxy-2-quinolinyl)-oxomethyl]-4-piperidinyl]-4-thiazolecarboxamide IUPAC Name: N-[(3-chloro-4-fluorophenyl)methyl]-2-[1-(4-methoxyquinoline-2-carbonyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide Traditional Name: N-(3-chloro-4-fluoro-benzyl)-2-[1-(4-methoxyquinoline-2-carbonyl)-4-piperidyl]thiazole-4-carboxamide Formula: C27H24ClFN4O3S MolecularWeight: 539.020863

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC2=CC=CC=C21)C(=O)N3CCC(CC3)C4=NC(=CS4)C(=O)NCC5=CC(=C(C=C5)F)Cl

Isomeric SMILES

COC1=CC(=NC2=CC=CC=C21)C(=O)N3CCC(CC3)C4=NC(=CS4)C(=O)NCC5=CC(=C(C=C5)F)Cl

InChI

InChI=1S/C27H24ClFN4O3S/c1-36-24-13-22(31-21-5-3-2-4-18(21)24)27(35)33-10-8-17(9-11-33)26-32-23(15-37-26)25(34)30-14-16-6-7-20(29)19(28)12-16/h2-7,12-13,15,17H,8-11,14H2,1H3,(H,30,34)