8-[(3,5-dimethyl-1,2-oxazol-4-yl)carbonyl]-N-(4-methylsulfanylphenyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide

Systemtic Name: 8-[(3,5-dimethyl-1,2-oxazol-4-yl)carbonyl]-N-(4-methylsulfanylphenyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide Openeye Name: 8-(3,5-dimethylisoxazole-4-carbonyl)-N-(4-methylsulfanylphenyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide CAS Name: 8-[(3,5-dimethyl-4-isoxazolyl)-oxomethyl]-N-[4-(methylthio)phenyl]-3,8-diazaspiro[4.5]decane-3-carbothioamide IUPAC Name: 8-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-N-(4-methylsulfanylphenyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide Traditional Name: 8-(3,5-dimethylisoxazole-4-carbonyl)-N-[4-(methylthio)phenyl]-3,8-diazaspiro[4.5]decane-3-carbothioamide Formula: C22H28N4O2S2 MolecularWeight: 444.61332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)C(=O)N2CCC3(CC2)CCN(C3)C(=S)NC4=CC=C(C=C4)SC

Isomeric SMILES

CC1=C(C(=NO1)C)C(=O)N2CCC3(CC2)CCN(C3)C(=S)NC4=CC=C(C=C4)SC

InChI

InChI=1S/C22H28N4O2S2/c1-15-19(16(2)28-24-15)20(27)25-11-8-22(9-12-25)10-13-26(14-22)21(29)23-17-4-6-18(30-3)7-5-17/h4-7H,8-14H2,1-3H3,(H,23,29)