N-(1-cyanocyclopentyl)-2-(5-morpholin-4-ylsulfonylpyridin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(1-cyanocyclopentyl)-2-(5-morpholin-4-ylsulfonylpyridin-2-yl)sulfanyl-ethanamide Openeye Name: N-(1-cyanocyclopentyl)-2-[(5-morpholinosulfonyl-2-pyridyl)sulfanyl]acetamide CAS Name: N-(1-cyanocyclopentyl)-2-[[5-(4-morpholinylsulfonyl)-2-pyridinyl]thio]acetamide IUPAC Name: N-(1-cyanocyclopentyl)-2-(5-morpholin-4-ylsulfonylpyridin-2-yl)sulfanylacetamide Traditional Name: N-(1-cyanocyclopentyl)-2-[(5-morpholinosulfonyl-2-pyridyl)thio]acetamide Formula: C17H22N4O4S2 MolecularWeight: 410.51098

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C#N)NC(=O)CSC2=NC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

C1CCC(C1)(C#N)NC(=O)CSC2=NC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C17H22N4O4S2/c18-13-17(5-1-2-6-17)20-15(22)12-26-16-4-3-14(11-19-16)27(23,24)21-7-9-25-10-8-21/h3-4,11H,1-2,5-10,12H2,(H,20,22)