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

Systemtic Name: N-(3-methoxyphenyl)-3-(5-oxidanylidene-5-thiophen-2-yl-pentanoyl)-3,8-diazaspiro[4.5]decane-8-carbothioamide Openeye Name: N-(3-methoxyphenyl)-3-[5-oxo-5-(2-thienyl)pentanoyl]-3,8-diazaspiro[4.5]decane-8-carbothioamide CAS Name: 3-(1,5-dioxo-5-thiophen-2-ylpentyl)-N-(3-methoxyphenyl)-3,8-diazaspiro[4.5]decane-8-carbothioamide IUPAC Name: N-(3-methoxyphenyl)-3-(5-oxo-5-thiophen-2-ylpentanoyl)-3,8-diazaspiro[4.5]decane-8-carbothioamide Traditional Name: 3-[5-keto-5-(2-thienyl)pentanoyl]-N-(3-methoxyphenyl)-3,8-diazaspiro[4.5]decane-8-carbothioamide Formula: C25H31N3O3S2 MolecularWeight: 485.66194

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=S)N2CCC3(CC2)CCN(C3)C(=O)CCCC(=O)C4=CC=CS4

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)N2CCC3(CC2)CCN(C3)C(=O)CCCC(=O)C4=CC=CS4

InChI

InChI=1S/C25H31N3O3S2/c1-31-20-6-2-5-19(17-20)26-24(32)27-13-10-25(11-14-27)12-15-28(18-25)23(30)9-3-7-21(29)22-8-4-16-33-22/h2,4-6,8,16-17H,3,7,9-15,18H2,1H3,(H,26,32)