N-(2-methylbutyl)-8-(3-phenylpropanoyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide

Systemtic Name: N-(2-methylbutyl)-8-(3-phenylpropanoyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Openeye Name: N-(2-methylbutyl)-8-(3-phenylpropanoyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide CAS Name: N-(2-methylbutyl)-8-(1-oxo-3-phenylpropyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide IUPAC Name: N-(2-methylbutyl)-8-(3-phenylpropanoyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Traditional Name: 8-hydrocinnamoyl-N-(2-methylbutyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Formula: C22H33N3O2S MolecularWeight: 403.58132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CNC(=O)C1CSC2(N1)CCN(CC2)C(=O)CCC3=CC=CC=C3

Isomeric SMILES

CCC(C)CNC(=O)C1CSC2(N1)CCN(CC2)C(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C22H33N3O2S/c1-3-17(2)15-23-21(27)19-16-28-22(24-19)11-13-25(14-12-22)20(26)10-9-18-7-5-4-6-8-18/h4-8,17,19,24H,3,9-16H2,1-2H3,(H,23,27)