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Concept information

Preferred term

4-mercapto-6-oxo-3-phenyl-2-thiophen-2-yl-1,2-dihydropyrimidine-5-carbonitrile  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C15H11N3OS2

inchi

  • InChI=1S/C15H11N3OS2/c16-9-11-14(19)17-13(12-7-4-8-21-12)18(15(11)20)10-5-2-1-3-6-10/h1-8,13,20H,(H,17,19)

inchikey

  • DVOZOHPFZNCFDJ-UHFFFAOYSA-N

mass

  • 313.400

monoisotopicmass

  • 313.03435

smiles

  • C1=CC=C(C=C1)N2C(NC(=O)C(=C2S)C#N)C3=CC=CS3

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:105511

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