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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=C1)C(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)C#CC4=CC=CC=C4

Isomeric SMILES

CN(CCC1=CC=CC=C1)C(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)C#CC4=CC=CC=C4

InChI

InChI=1S/C27H27N3O2S/c1-29(17-14-22-10-6-3-7-11-22)27(32)24-20-33-26(28-24)23-15-18-30(19-16-23)25(31)13-12-21-8-4-2-5-9-21/h2-11,20,23H,14-19H2,1H3