N-(4-bromanyl-2,6-dimethyl-phenyl)-2-[(4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(4-bromanyl-2,6-dimethyl-phenyl)-2-[(4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanamide Openeye Name: N-(4-bromo-2,6-dimethyl-phenyl)-2-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]acetamide CAS Name: N-(4-bromo-2,6-dimethylphenyl)-2-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)thio]acetamide IUPAC Name: N-(4-bromo-2,6-dimethylphenyl)-2-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]acetamide Traditional Name: N-(4-bromo-2,6-dimethyl-phenyl)-2-[(4-hydroxy-6-keto-1H-pyrimidin-2-yl)thio]acetamide Formula: C14H14BrN3O3S MolecularWeight: 384.24826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC(=O)CSC2=NC(=CC(=O)N2)O)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1NC(=O)CSC2=NC(=CC(=O)N2)O)C)Br

InChI

InChI=1S/C14H14BrN3O3S/c1-7-3-9(15)4-8(2)13(7)16-12(21)6-22-14-17-10(19)5-11(20)18-14/h3-5H,6H2,1-2H3,(H,16,21)(H2,17,18,19,20)