N-(3-imidazol-1-ylpropyl)-2-[1-(3-phenylprop-2-ynoyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-(3-imidazol-1-ylpropyl)-2-[1-(3-phenylprop-2-ynoyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide Openeye Name: N-(3-imidazol-1-ylpropyl)-2-[1-(3-phenylprop-2-ynoyl)-4-piperidyl]thiazole-4-carboxamide CAS Name: N-[3-(1-imidazolyl)propyl]-2-[1-(1-oxo-3-phenylprop-2-ynyl)-4-piperidinyl]-4-thiazolecarboxamide IUPAC Name: N-(3-imidazol-1-ylpropyl)-2-[1-(3-phenylprop-2-ynoyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide Traditional Name: N-(3-imidazol-1-ylpropyl)-2-[1-(3-phenylpropioloyl)-4-piperidyl]thiazole-4-carboxamide Formula: C24H25N5O2S MolecularWeight: 447.5526

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC(=CS2)C(=O)NCCCN3C=CN=C3)C(=O)C#CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C2=NC(=CS2)C(=O)NCCCN3C=CN=C3)C(=O)C#CC4=CC=CC=C4

InChI

InChI=1S/C24H25N5O2S/c30-22(8-7-19-5-2-1-3-6-19)29-14-9-20(10-15-29)24-27-21(17-32-24)23(31)26-11-4-13-28-16-12-25-18-28/h1-3,5-6,12,16-18,20H,4,9-11,13-15H2,(H,26,31)