N-(4-bromanyl-2-chloranyl-phenyl)-8-(2-methylsulfanylpyridin-3-yl)carbonyl-3,8-diazaspiro[4.5]decane-3-carboxamide

Systemtic Name: N-(4-bromanyl-2-chloranyl-phenyl)-8-(2-methylsulfanylpyridin-3-yl)carbonyl-3,8-diazaspiro[4.5]decane-3-carboxamide Openeye Name: N-(4-bromo-2-chloro-phenyl)-8-(2-methylsulfanylpyridine-3-carbonyl)-3,8-diazaspiro[4.5]decane-3-carboxamide CAS Name: N-(4-bromo-2-chlorophenyl)-8-[[2-(methylthio)-3-pyridinyl]-oxomethyl]-3,8-diazaspiro[4.5]decane-3-carboxamide IUPAC Name: N-(4-bromo-2-chlorophenyl)-8-(2-methylsulfanylpyridine-3-carbonyl)-3,8-diazaspiro[4.5]decane-3-carboxamide Traditional Name: N-(4-bromo-2-chloro-phenyl)-8-[2-(methylthio)nicotinoyl]-3,8-diazaspiro[4.5]decane-3-carboxamide Formula: C22H24BrClN4O2S MolecularWeight: 523.87356

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)N2CCC3(CC2)CCN(C3)C(=O)NC4=C(C=C(C=C4)Br)Cl

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)N2CCC3(CC2)CCN(C3)C(=O)NC4=C(C=C(C=C4)Br)Cl

InChI

InChI=1S/C22H24BrClN4O2S/c1-31-19-16(3-2-9-25-19)20(29)27-10-6-22(7-11-27)8-12-28(14-22)21(30)26-18-5-4-15(23)13-17(18)24/h2-5,9,13H,6-8,10-12,14H2,1H3,(H,26,30)