Products 289504-81-0

CAS 289504-81-0 is the registry number for 2-((2-(4-Chloro-3-methylphenyl)-2-oxoethyl)thio)-4-hydroxy-6-(thiophen-2-yl)pyrimidine-5-carbonitrile, 98%. Offered by: Chemat Brand. Available pack sizes: on request.

2-((2-(4-Chloro-3-methylphenyl)-2-oxoethyl)thio)-4-hydroxy-6-(thiophen-2-yl)pyrimidine-5-carbonitrile, 98%
Chemat Brand
  • size: on request
  • Variants: 1
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Structural formula: {0} (CAS {1})

2-[2-(4-chloro-3-methylphenyl)-2-oxoethyl]sulfanyl-6-oxo-4-thiophen-2-yl-1H-pyrimidine-5-carbonitrile (CAS 289504-81-0) is a chemical compound with the molecular formula C18H12ClN3O2S2 and a molecular weight of 401.9 g/mol. IUPAC name: 2-[2-(4-chloro-3-methylphenyl)-2-oxoethyl]sulfanyl-6-oxo-4-thiophen-2-yl-1H-pyrimidine-5-carbonitrile. InChIKey: SRKGVOUOXSXNFL-UHFFFAOYSA-N.

Identity
Molecular formulaC18H12ClN3O2S2
Molecular weight401.9 g/mol
IUPAC name2-[2-(4-chloro-3-methylphenyl)-2-oxoethyl]sulfanyl-6-oxo-4-thiophen-2-yl-1H-pyrimidine-5-carbonitrile
InChIKeySRKGVOUOXSXNFL-UHFFFAOYSA-N
SMILESCC1=C(C=CC(=C1)C(=O)CSC2=NC(=C(C(=O)N2)C#N)C3=CC=CS3)Cl

Computed by PubChem (NCBI)

Isomers (same molecular formula)
2-[3-[(4-chloro-5-cyano-6-thiophen-2-ylpyrimidin-2-yl)sulfanylmethyl]phenyl]acetic acid C18H12ClN3O2S2
(5Z)-5-[(4-chlorophenyl)methylidene]-2-[(6-methoxy-1,3-benzothiazol-2-yl)imino]-1,3-thiazolidin-4-one C18H12ClN3O2S2