4-butyl-N-(2-methoxyphenyl)-2-(2-methylsulfanylethyl)-3-oxidanylidene-1,4,8-triazaspiro[4.5]decane-8-carbothioamide

Systemtic Name: 4-butyl-N-(2-methoxyphenyl)-2-(2-methylsulfanylethyl)-3-oxidanylidene-1,4,8-triazaspiro[4.5]decane-8-carbothioamide Openeye Name: 4-butyl-N-(2-methoxyphenyl)-2-(2-methylsulfanylethyl)-3-oxo-1,4,8-triazaspiro[4.5]decane-8-carbothioamide CAS Name: 4-butyl-N-(2-methoxyphenyl)-2-[2-(methylthio)ethyl]-3-oxo-1,4,8-triazaspiro[4.5]decane-8-carbothioamide IUPAC Name: 4-butyl-N-(2-methoxyphenyl)-2-(2-methylsulfanylethyl)-3-oxo-1,4,8-triazaspiro[4.5]decane-8-carbothioamide Traditional Name: 4-butyl-3-keto-N-(2-methoxyphenyl)-2-[2-(methylthio)ethyl]-1,4,8-triazaspiro[4.5]decane-8-carbothioamide Formula: C22H34N4O2S2 MolecularWeight: 450.66096

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(NC12CCN(CC2)C(=S)NC3=CC=CC=C3OC)CCSC

Isomeric SMILES

CCCCN1C(=O)C(NC12CCN(CC2)C(=S)NC3=CC=CC=C3OC)CCSC

InChI

InChI=1S/C22H34N4O2S2/c1-4-5-13-26-20(27)18(10-16-30-3)24-22(26)11-14-25(15-12-22)21(29)23-17-8-6-7-9-19(17)28-2/h6-9,18,24H,4-5,10-16H2,1-3H3,(H,23,29)