N-(8-oxidanylquinolin-5-yl)-2-[1-(3-phenylprop-2-ynoyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-(8-oxidanylquinolin-5-yl)-2-[1-(3-phenylprop-2-ynoyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide Openeye Name: N-(8-hydroxy-5-quinolyl)-2-[1-(3-phenylprop-2-ynoyl)-4-piperidyl]thiazole-4-carboxamide CAS Name: N-(8-hydroxy-5-quinolinyl)-2-[1-(1-oxo-3-phenylprop-2-ynyl)-4-piperidinyl]-4-thiazolecarboxamide IUPAC Name: N-(8-hydroxyquinolin-5-yl)-2-[1-(3-phenylprop-2-ynoyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide Traditional Name: N-(8-hydroxy-5-quinolyl)-2-[1-(3-phenylpropioloyl)-4-piperidyl]thiazole-4-carboxamide Formula: C27H22N4O3S MolecularWeight: 482.55358

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC(=CS2)C(=O)NC3=C4C=CC=NC4=C(C=C3)O)C(=O)C#CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C2=NC(=CS2)C(=O)NC3=C4C=CC=NC4=C(C=C3)O)C(=O)C#CC5=CC=CC=C5

InChI

InChI=1S/C27H22N4O3S/c32-23-10-9-21(20-7-4-14-28-25(20)23)29-26(34)22-17-35-27(30-22)19-12-15-31(16-13-19)24(33)11-8-18-5-2-1-3-6-18/h1-7,9-10,14,17,19,32H,12-13,15-16H2,(H,29,34)