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

Systemtic Name: N-ethyl-N-(phenylmethyl)-2-[1-(3-phenylprop-2-ynoyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide Openeye Name: N-benzyl-N-ethyl-2-[1-(3-phenylprop-2-ynoyl)-4-piperidyl]thiazole-4-carboxamide CAS Name: N-ethyl-2-[1-(1-oxo-3-phenylprop-2-ynyl)-4-piperidinyl]-N-(phenylmethyl)-4-thiazolecarboxamide IUPAC Name: N-benzyl-N-ethyl-2-[1-(3-phenylprop-2-ynoyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide Traditional Name: N-benzyl-N-ethyl-2-[1-(3-phenylpropioloyl)-4-piperidyl]thiazole-4-carboxamide Formula: C27H27N3O2S MolecularWeight: 457.58718

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)C#CC4=CC=CC=C4

Isomeric SMILES

CCN(CC1=CC=CC=C1)C(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)C#CC4=CC=CC=C4

InChI

InChI=1S/C27H27N3O2S/c1-2-29(19-22-11-7-4-8-12-22)27(32)24-20-33-26(28-24)23-15-17-30(18-16-23)25(31)14-13-21-9-5-3-6-10-21/h3-12,20,23H,2,15-19H2,1H3