ethyl 4-[[2-[1-(3-phenylprop-2-ynoyl)piperidin-4-yl]-1,3-thiazol-4-yl]carbonyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[[2-[1-(3-phenylprop-2-ynoyl)piperidin-4-yl]-1,3-thiazol-4-yl]carbonyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[1-(3-phenylprop-2-ynoyl)-4-piperidyl]thiazole-4-carbonyl]piperazine-1-carboxylate CAS Name: 4-[oxo-[2-[1-(1-oxo-3-phenylprop-2-ynyl)-4-piperidinyl]-4-thiazolyl]methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[1-(3-phenylprop-2-ynoyl)piperidin-4-yl]-1,3-thiazole-4-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[2-[1-(3-phenylpropioloyl)-4-piperidyl]thiazole-4-carbonyl]piperazine-1-carboxylic acid ethyl ester Formula: C25H28N4O4S MolecularWeight: 480.57922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)C#CC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)C#CC4=CC=CC=C4

InChI

InChI=1S/C25H28N4O4S/c1-2-33-25(32)29-16-14-28(15-17-29)24(31)21-18-34-23(26-21)20-10-12-27(13-11-20)22(30)9-8-19-6-4-3-5-7-19/h3-7,18,20H,2,10-17H2,1H3