1-[8-(3-phenylprop-2-ynoyl)-3,8-diazaspiro[4.5]decan-3-yl]-5-thiophen-2-yl-pentane-1,5-dione

Systemtic Name: 1-[8-(3-phenylprop-2-ynoyl)-3,8-diazaspiro[4.5]decan-3-yl]-5-thiophen-2-yl-pentane-1,5-dione Openeye Name: 1-[8-(3-phenylprop-2-ynoyl)-3,8-diazaspiro[4.5]decan-3-yl]-5-(2-thienyl)pentane-1,5-dione CAS Name: 1-[8-(1-oxo-3-phenylprop-2-ynyl)-3,8-diazaspiro[4.5]decan-3-yl]-5-thiophen-2-ylpentane-1,5-dione IUPAC Name: 1-[8-(3-phenylprop-2-ynoyl)-3,8-diazaspiro[4.5]decan-3-yl]-5-thiophen-2-ylpentane-1,5-dione Traditional Name: 1-[8-(3-phenylpropioloyl)-3,8-diazaspiro[4.5]decan-3-yl]-5-(2-thienyl)pentane-1,5-dione Formula: C26H28N2O3S MolecularWeight: 448.57712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12CCN(C2)C(=O)CCCC(=O)C3=CC=CS3)C(=O)C#CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC12CCN(C2)C(=O)CCCC(=O)C3=CC=CS3)C(=O)C#CC4=CC=CC=C4

InChI

InChI=1S/C26H28N2O3S/c29-22(23-9-5-19-32-23)8-4-10-24(30)28-18-15-26(20-28)13-16-27(17-14-26)25(31)12-11-21-6-2-1-3-7-21/h1-3,5-7,9,19H,4,8,10,13-18,20H2