8-(2-methylsulfanylpyridin-3-yl)carbonyl-N-(1-phenylethyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide

Systemtic Name: 8-(2-methylsulfanylpyridin-3-yl)carbonyl-N-(1-phenylethyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide Openeye Name: 8-(2-methylsulfanylpyridine-3-carbonyl)-N-(1-phenylethyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide CAS Name: 8-[[2-(methylthio)-3-pyridinyl]-oxomethyl]-N-(1-phenylethyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide IUPAC Name: 8-(2-methylsulfanylpyridine-3-carbonyl)-N-(1-phenylethyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide Traditional Name: 8-[2-(methylthio)nicotinoyl]-N-(1-phenylethyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide Formula: C24H30N4OS2 MolecularWeight: 454.6512

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H30N4OS2/c1-18(19-7-4-3-5-8-19)26-23(30)28-16-12-24(17-28)10-14-27(15-11-24)22(29)20-9-6-13-25-21(20)31-2/h3-9,13,18H,10-12,14-17H2,1-2H3,(H,26,30)