8-(4-ethanoylphenyl)carbonyl-N-(1-phenylethyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide

Systemtic Name: 8-(4-ethanoylphenyl)carbonyl-N-(1-phenylethyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide Openeye Name: 8-(4-acetylbenzoyl)-N-(1-phenylethyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide CAS Name: 8-[(4-acetylphenyl)-oxomethyl]-N-(1-phenylethyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide IUPAC Name: 8-(4-acetylbenzoyl)-N-(1-phenylethyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide Traditional Name: 8-(4-acetylbenzoyl)-N-(1-phenylethyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide Formula: C26H31N3O2S MolecularWeight: 449.60824

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H31N3O2S/c1-19(21-6-4-3-5-7-21)27-25(32)29-17-14-26(18-29)12-15-28(16-13-26)24(31)23-10-8-22(9-11-23)20(2)30/h3-11,19H,12-18H2,1-2H3,(H,27,32)