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

Systemtic Name: N-[1-(phenylmethyl)piperidin-4-yl]-2-[1-(3-phenylprop-2-ynoyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide Openeye Name: N-(1-benzyl-4-piperidyl)-2-[1-(3-phenylprop-2-ynoyl)-4-piperidyl]thiazole-4-carboxamide CAS Name: 2-[1-(1-oxo-3-phenylprop-2-ynyl)-4-piperidinyl]-N-[1-(phenylmethyl)-4-piperidinyl]-4-thiazolecarboxamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-2-[1-(3-phenylprop-2-ynoyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide Traditional Name: N-(1-benzyl-4-piperidyl)-2-[1-(3-phenylpropioloyl)-4-piperidyl]thiazole-4-carboxamide Formula: C30H32N4O2S MolecularWeight: 512.66568

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC(=CS2)C(=O)NC3CCN(CC3)CC4=CC=CC=C4)C(=O)C#CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C2=NC(=CS2)C(=O)NC3CCN(CC3)CC4=CC=CC=C4)C(=O)C#CC5=CC=CC=C5

InChI

InChI=1S/C30H32N4O2S/c35-28(12-11-23-7-3-1-4-8-23)34-19-13-25(14-20-34)30-32-27(22-37-30)29(36)31-26-15-17-33(18-16-26)21-24-9-5-2-6-10-24/h1-10,22,25-26H,13-21H2,(H,31,36)