2-(2-phenylsulfanylpyridin-3-yl)carbonyl-N-(2-pyridin-3-yl-2-pyrrolidin-1-yl-ethyl)-2,8-diazaspiro[4.5]decane-4-carboxamide

Systemtic Name: 2-(2-phenylsulfanylpyridin-3-yl)carbonyl-N-(2-pyridin-3-yl-2-pyrrolidin-1-yl-ethyl)-2,8-diazaspiro[4.5]decane-4-carboxamide Openeye Name: 2-(2-phenylsulfanylpyridine-3-carbonyl)-N-[2-(3-pyridyl)-2-pyrrolidin-1-yl-ethyl]-2,8-diazaspiro[4.5]decane-4-carboxamide CAS Name: 2-[oxo-[2-(phenylthio)-3-pyridinyl]methyl]-N-[2-(3-pyridinyl)-2-(1-pyrrolidinyl)ethyl]-2,8-diazaspiro[4.5]decane-4-carboxamide IUPAC Name: 2-(2-phenylsulfanylpyridine-3-carbonyl)-N-(2-pyridin-3-yl-2-pyrrolidin-1-ylethyl)-2,8-diazaspiro[4.5]decane-4-carboxamide Traditional Name: 2-[2-(phenylthio)nicotinoyl]-N-[2-(3-pyridyl)-2-pyrrolidino-ethyl]-2,8-diazaspiro[4.5]decane-4-carboxamide Formula: C32H38N6O2S MolecularWeight: 570.74812

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC(=O)C2CN(CC23CCNCC3)C(=O)C4=C(N=CC=C4)SC5=CC=CC=C5)C6=CN=CC=C6

Isomeric SMILES

C1CCN(C1)C(CNC(=O)C2CN(CC23CCNCC3)C(=O)C4=C(N=CC=C4)SC5=CC=CC=C5)C6=CN=CC=C6

InChI

InChI=1S/C32H38N6O2S/c39-29(36-21-28(37-18-4-5-19-37)24-8-6-14-34-20-24)27-22-38(23-32(27)12-16-33-17-13-32)31(40)26-11-7-15-35-30(26)41-25-9-2-1-3-10-25/h1-3,6-11,14-15,20,27-28,33H,4-5,12-13,16-19,21-23H2,(H,36,39)