N-(3,5-dimethylphenyl)-3-(5-oxidanylidene-5-thiophen-2-yl-pentanoyl)-3,8-diazaspiro[4.5]decane-8-carbothioamide

Systemtic Name: N-(3,5-dimethylphenyl)-3-(5-oxidanylidene-5-thiophen-2-yl-pentanoyl)-3,8-diazaspiro[4.5]decane-8-carbothioamide Openeye Name: N-(3,5-dimethylphenyl)-3-[5-oxo-5-(2-thienyl)pentanoyl]-3,8-diazaspiro[4.5]decane-8-carbothioamide CAS Name: N-(3,5-dimethylphenyl)-3-(1,5-dioxo-5-thiophen-2-ylpentyl)-3,8-diazaspiro[4.5]decane-8-carbothioamide IUPAC Name: N-(3,5-dimethylphenyl)-3-(5-oxo-5-thiophen-2-ylpentanoyl)-3,8-diazaspiro[4.5]decane-8-carbothioamide Traditional Name: N-(3,5-dimethylphenyl)-3-[5-keto-5-(2-thienyl)pentanoyl]-3,8-diazaspiro[4.5]decane-8-carbothioamide Formula: C26H33N3O2S2 MolecularWeight: 483.68912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)N2CCC3(CC2)CCN(C3)C(=O)CCCC(=O)C4=CC=CS4)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)N2CCC3(CC2)CCN(C3)C(=O)CCCC(=O)C4=CC=CS4)C

InChI

InChI=1S/C26H33N3O2S2/c1-19-15-20(2)17-21(16-19)27-25(32)28-11-8-26(9-12-28)10-13-29(18-26)24(31)7-3-5-22(30)23-6-4-14-33-23/h4,6,14-17H,3,5,7-13,18H2,1-2H3,(H,27,32)