8-(4-ethanoylphenyl)carbonyl-N-(oxolan-2-ylmethyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide

Systemtic Name: 8-(4-ethanoylphenyl)carbonyl-N-(oxolan-2-ylmethyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide Openeye Name: 8-(4-acetylbenzoyl)-N-(tetrahydrofuran-2-ylmethyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide CAS Name: 8-[(4-acetylphenyl)-oxomethyl]-N-(2-oxolanylmethyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide IUPAC Name: 8-(4-acetylbenzoyl)-N-(oxolan-2-ylmethyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide Traditional Name: 8-(4-acetylbenzoyl)-N-(tetrahydrofurfuryl)-3,8-diazaspiro[4.5]decane-3-carbothioamide Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)C(=O)N2CCC3(CC2)CCN(C3)C(=S)NCC4CCCO4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)C(=O)N2CCC3(CC2)CCN(C3)C(=S)NCC4CCCO4

InChI

InChI=1S/C23H31N3O3S/c1-17(27)18-4-6-19(7-5-18)21(28)25-11-8-23(9-12-25)10-13-26(16-23)22(30)24-15-20-3-2-14-29-20/h4-7,20H,2-3,8-16H2,1H3,(H,24,30)