methyl (1S)-4-ethyl-3-oxidanylidene-8-(2-pyridin-2-ylsulfanylethanoyl)-4,8-diazaspiro[4.5]decane-1-carboxylate

Systemtic Name: methyl (1S)-4-ethyl-3-oxidanylidene-8-(2-pyridin-2-ylsulfanylethanoyl)-4,8-diazaspiro[4.5]decane-1-carboxylate Openeye Name: methyl (1S)-4-ethyl-3-oxo-8-[2-(2-pyridylsulfanyl)acetyl]-4,8-diazaspiro[4.5]decane-1-carboxylate CAS Name: (1S)-4-ethyl-3-oxo-8-[1-oxo-2-(2-pyridinylthio)ethyl]-4,8-diazaspiro[4.5]decane-1-carboxylic acid methyl ester IUPAC Name: methyl (1S)-4-ethyl-3-oxo-8-(2-pyridin-2-ylsulfanylacetyl)-4,8-diazaspiro[4.5]decane-1-carboxylate Traditional Name: (1S)-4-ethyl-3-keto-8-[2-(2-pyridylthio)acetyl]-4,8-diazaspiro[4.5]decane-1-carboxylic acid methyl ester Formula: C19H25N3O4S MolecularWeight: 391.4845

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)CC(C12CCN(CC2)C(=O)CSC3=CC=CC=N3)C(=O)OC

Isomeric SMILES

CCN1C(=O)C[C@@H](C12CCN(CC2)C(=O)CSC3=CC=CC=N3)C(=O)OC

InChI

InChI=1S/C19H25N3O4S/c1-3-22-16(23)12-14(18(25)26-2)19(22)7-10-21(11-8-19)17(24)13-27-15-6-4-5-9-20-15/h4-6,9,14H,3,7-8,10-13H2,1-2H3/t14-/m1/s1