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

Systemtic Name: N-ethyl-2-[1-(3-phenylprop-2-ynoyl)piperidin-4-yl]-N-(1,3,4-thiadiazol-2-yl)-1,3-thiazole-4-carboxamide Openeye Name: N-ethyl-2-[1-(3-phenylprop-2-ynoyl)-4-piperidyl]-N-(1,3,4-thiadiazol-2-yl)thiazole-4-carboxamide CAS Name: N-ethyl-2-[1-(1-oxo-3-phenylprop-2-ynyl)-4-piperidinyl]-N-(1,3,4-thiadiazol-2-yl)-4-thiazolecarboxamide IUPAC Name: N-ethyl-2-[1-(3-phenylprop-2-ynoyl)piperidin-4-yl]-N-(1,3,4-thiadiazol-2-yl)-1,3-thiazole-4-carboxamide Traditional Name: N-ethyl-2-[1-(3-phenylpropioloyl)-4-piperidyl]-N-(1,3,4-thiadiazol-2-yl)thiazole-4-carboxamide Formula: C22H21N5O2S2 MolecularWeight: 451.56444

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=NN=CS1)C(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)C#CC4=CC=CC=C4

Isomeric SMILES

CCN(C1=NN=CS1)C(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)C#CC4=CC=CC=C4

InChI

InChI=1S/C22H21N5O2S2/c1-2-27(22-25-23-15-31-22)21(29)18-14-30-20(24-18)17-10-12-26(13-11-17)19(28)9-8-16-6-4-3-5-7-16/h3-7,14-15,17H,2,10-13H2,1H3