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

Systemtic Name: 2-[1-(4-methoxyquinolin-2-yl)carbonylpiperidin-4-yl]-N-[1-(phenylmethyl)pyrrolidin-3-yl]-1,3-thiazole-4-carboxamide Openeye Name: N-(1-benzylpyrrolidin-3-yl)-2-[1-(4-methoxyquinoline-2-carbonyl)-4-piperidyl]thiazole-4-carboxamide CAS Name: 2-[1-[(4-methoxy-2-quinolinyl)-oxomethyl]-4-piperidinyl]-N-[1-(phenylmethyl)-3-pyrrolidinyl]-4-thiazolecarboxamide IUPAC Name: N-(1-benzylpyrrolidin-3-yl)-2-[1-(4-methoxyquinoline-2-carbonyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide Traditional Name: N-(1-benzylpyrrolidin-3-yl)-2-[1-(4-methoxyquinoline-2-carbonyl)-4-piperidyl]thiazole-4-carboxamide Formula: C31H33N5O3S MolecularWeight: 555.69042

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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)NC5CCN(C5)CC6=CC=CC=C6

Isomeric SMILES

COC1=CC(=NC2=CC=CC=C21)C(=O)N3CCC(CC3)C4=NC(=CS4)C(=O)NC5CCN(C5)CC6=CC=CC=C6

InChI

InChI=1S/C31H33N5O3S/c1-39-28-17-26(33-25-10-6-5-9-24(25)28)31(38)36-15-11-22(12-16-36)30-34-27(20-40-30)29(37)32-23-13-14-35(19-23)18-21-7-3-2-4-8-21/h2-10,17,20,22-23H,11-16,18-19H2,1H3,(H,32,37)