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

Systemtic Name: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-2-[1-(3-phenylprop-2-ynoyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide Openeye Name: N-[2-(2-furylmethylsulfanyl)ethyl]-2-[1-(3-phenylprop-2-ynoyl)-4-piperidyl]thiazole-4-carboxamide CAS Name: N-[2-(2-furanylmethylthio)ethyl]-2-[1-(1-oxo-3-phenylprop-2-ynyl)-4-piperidinyl]-4-thiazolecarboxamide IUPAC Name: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-2-[1-(3-phenylprop-2-ynoyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide Traditional Name: N-[2-(2-furfurylthio)ethyl]-2-[1-(3-phenylpropioloyl)-4-piperidyl]thiazole-4-carboxamide Formula: C25H25N3O3S2 MolecularWeight: 479.6143

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC(=CS2)C(=O)NCCSCC3=CC=CO3)C(=O)C#CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C2=NC(=CS2)C(=O)NCCSCC3=CC=CO3)C(=O)C#CC4=CC=CC=C4

InChI

InChI=1S/C25H25N3O3S2/c29-23(9-8-19-5-2-1-3-6-19)28-13-10-20(11-14-28)25-27-22(18-33-25)24(30)26-12-16-32-17-21-7-4-15-31-21/h1-7,15,18,20H,10-14,16-17H2,(H,26,30)