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

Systemtic Name: N-(1-ethynylcyclohexyl)-2-[1-(4-methoxyquinolin-2-yl)carbonylpiperidin-4-yl]-1,3-thiazole-4-carboxamide Openeye Name: N-(1-ethynylcyclohexyl)-2-[1-(4-methoxyquinoline-2-carbonyl)-4-piperidyl]thiazole-4-carboxamide CAS Name: N-(1-ethynylcyclohexyl)-2-[1-[(4-methoxy-2-quinolinyl)-oxomethyl]-4-piperidinyl]-4-thiazolecarboxamide IUPAC Name: N-(1-ethynylcyclohexyl)-2-[1-(4-methoxyquinoline-2-carbonyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide Traditional Name: N-(1-ethynylcyclohexyl)-2-[1-(4-methoxyquinoline-2-carbonyl)-4-piperidyl]thiazole-4-carboxamide Formula: C28H30N4O3S MolecularWeight: 502.6278

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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)NC5(CCCCC5)C#C

Isomeric SMILES

COC1=CC(=NC2=CC=CC=C21)C(=O)N3CCC(CC3)C4=NC(=CS4)C(=O)NC5(CCCCC5)C#C

InChI

InChI=1S/C28H30N4O3S/c1-3-28(13-7-4-8-14-28)31-25(33)23-18-36-26(30-23)19-11-15-32(16-12-19)27(34)22-17-24(35-2)20-9-5-6-10-21(20)29-22/h1,5-6,9-10,17-19H,4,7-8,11-16H2,2H3,(H,31,33)