N-(3-chloranyl-4-methoxy-phenyl)-3-[(4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]propanamide

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-3-[(4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]propanamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-3-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]propanamide CAS Name: N-(3-chloro-4-methoxyphenyl)-3-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)thio]propanamide IUPAC Name: N-(3-chloro-4-methoxyphenyl)-3-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]propanamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-3-[(4-hydroxy-6-keto-1H-pyrimidin-2-yl)thio]propionamide Formula: C14H14ClN3O4S MolecularWeight: 355.79666

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CCSC2=NC(=CC(=O)N2)O)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CCSC2=NC(=CC(=O)N2)O)Cl

InChI

InChI=1S/C14H14ClN3O4S/c1-22-10-3-2-8(6-9(10)15)16-11(19)4-5-23-14-17-12(20)7-13(21)18-14/h2-3,6-7H,4-5H2,1H3,(H,16,19)(H2,17,18,20,21)