2-[(5-heptyl-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanamide

Systemtic Name: 2-[(5-heptyl-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanamide Openeye Name: 2-[(5-heptyl-4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]acetamide CAS Name: 2-[(5-heptyl-4-hydroxy-6-oxo-1H-pyrimidin-2-yl)thio]acetamide IUPAC Name: 2-[(5-heptyl-4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]acetamide Traditional Name: 2-[(5-heptyl-4-hydroxy-6-keto-1H-pyrimidin-2-yl)thio]acetamide Formula: C13H21N3O3S MolecularWeight: 299.38914

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=C(N=C(NC1=O)SCC(=O)N)O

Isomeric SMILES

CCCCCCCC1=C(N=C(NC1=O)SCC(=O)N)O

InChI

InChI=1S/C13H21N3O3S/c1-2-3-4-5-6-7-9-11(18)15-13(16-12(9)19)20-8-10(14)17/h2-8H2,1H3,(H2,14,17)(H2,15,16,18,19)