N-(4-methylsulfanylphenyl)-8-(4-phenoxybutanoyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide

Systemtic Name: N-(4-methylsulfanylphenyl)-8-(4-phenoxybutanoyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide Openeye Name: N-(4-methylsulfanylphenyl)-8-(4-phenoxybutanoyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide CAS Name: N-[4-(methylthio)phenyl]-8-(1-oxo-4-phenoxybutyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide IUPAC Name: N-(4-methylsulfanylphenyl)-8-(4-phenoxybutanoyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide Traditional Name: N-[4-(methylthio)phenyl]-8-(4-phenoxybutanoyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide Formula: C26H33N3O2S2 MolecularWeight: 483.68912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)NC(=S)N2CCC3(C2)CCN(CC3)C(=O)CCCOC4=CC=CC=C4

Isomeric SMILES

CSC1=CC=C(C=C1)NC(=S)N2CCC3(C2)CCN(CC3)C(=O)CCCOC4=CC=CC=C4

InChI

InChI=1S/C26H33N3O2S2/c1-33-23-11-9-21(10-12-23)27-25(32)29-18-15-26(20-29)13-16-28(17-14-26)24(30)8-5-19-31-22-6-3-2-4-7-22/h2-4,6-7,9-12H,5,8,13-20H2,1H3,(H,27,32)