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

Systemtic Name: 2-[1-(4-methoxyquinolin-2-yl)carbonylpiperidin-4-yl]-N-[(2-methylsulfanylphenyl)methyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-[1-(4-methoxyquinoline-2-carbonyl)-4-piperidyl]-N-[(2-methylsulfanylphenyl)methyl]thiazole-4-carboxamide CAS Name: 2-[1-[(4-methoxy-2-quinolinyl)-oxomethyl]-4-piperidinyl]-N-[[2-(methylthio)phenyl]methyl]-4-thiazolecarboxamide IUPAC Name: 2-[1-(4-methoxyquinoline-2-carbonyl)piperidin-4-yl]-N-[(2-methylsulfanylphenyl)methyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-[1-(4-methoxyquinoline-2-carbonyl)-4-piperidyl]-N-[2-(methylthio)benzyl]thiazole-4-carboxamide Formula: C28H28N4O3S2 MolecularWeight: 532.67692

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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=CC=C5SC

Isomeric SMILES

COC1=CC(=NC2=CC=CC=C21)C(=O)N3CCC(CC3)C4=NC(=CS4)C(=O)NCC5=CC=CC=C5SC

InChI

InChI=1S/C28H28N4O3S2/c1-35-24-15-22(30-21-9-5-4-8-20(21)24)28(34)32-13-11-18(12-14-32)27-31-23(17-37-27)26(33)29-16-19-7-3-6-10-25(19)36-2/h3-10,15,17-18H,11-14,16H2,1-2H3,(H,29,33)