N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-butyl-2-(3-cyano-5-ethanoyl-6-methyl-pyridin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-butyl-2-(3-cyano-5-ethanoyl-6-methyl-pyridin-2-yl)sulfanyl-ethanamide Openeye Name: 2-[(5-acetyl-3-cyano-6-methyl-2-pyridyl)sulfanyl]-N-butyl-N-[(3S)-1,1-dioxothiolan-3-yl]acetamide CAS Name: 2-[(5-acetyl-3-cyano-6-methyl-2-pyridinyl)thio]-N-butyl-N-[(3S)-1,1-dioxo-3-thiolanyl]acetamide IUPAC Name: 2-(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl-N-butyl-N-[(3S)-1,1-dioxothiolan-3-yl]acetamide Traditional Name: 2-[(5-acetyl-3-cyano-6-methyl-2-pyridyl)thio]-N-butyl-N-[(3S)-1,1-diketothiolan-3-yl]acetamide Formula: C19H25N3O4S2 MolecularWeight: 423.5495

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1CCS(=O)(=O)C1)C(=O)CSC2=NC(=C(C=C2C#N)C(=O)C)C

Isomeric SMILES

CCCCN([C@H]1CCS(=O)(=O)C1)C(=O)CSC2=NC(=C(C=C2C#N)C(=O)C)C

InChI

InChI=1S/C19H25N3O4S2/c1-4-5-7-22(16-6-8-28(25,26)12-16)18(24)11-27-19-15(10-20)9-17(14(3)23)13(2)21-19/h9,16H,4-8,11-12H2,1-3H3/t16-/m0/s1