N-(2,5-dimethylphenyl)-2-[(4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]propanamide

Systemtic Name: N-(2,5-dimethylphenyl)-2-[(4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]propanamide Openeye Name: N-(2,5-dimethylphenyl)-2-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]propanamide CAS Name: N-(2,5-dimethylphenyl)-2-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)thio]propanamide IUPAC Name: N-(2,5-dimethylphenyl)-2-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]propanamide Traditional Name: N-(2,5-dimethylphenyl)-2-[(4-hydroxy-6-keto-1H-pyrimidin-2-yl)thio]propionamide Formula: C15H17N3O3S MolecularWeight: 319.37878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C(C)SC2=NC(=CC(=O)N2)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)C(C)SC2=NC(=CC(=O)N2)O

InChI

InChI=1S/C15H17N3O3S/c1-8-4-5-9(2)11(6-8)16-14(21)10(3)22-15-17-12(19)7-13(20)18-15/h4-7,10H,1-3H3,(H,16,21)(H2,17,18,19,20)