(2E)-2-Cyano-3-(3,4-Dihydroxyphenyl)-2-Propenethioamide
[CAS# 122520-86-9]

Identification

• Classification: Biochemical >> Amino acids and their derivatives >> Tyrosine derivatives
• Name: (2E)-2-Cyano-3-(3,4-Dihydroxyphenyl)-2-Propenethioamide
• Synonyms: 3-Amino-2-[(3-Hydroxy-4-Oxo-1-Cyclohexa-2,5-Dienylidene)Methyl]-3-Sulfanyl-Prop-2-Enenitrile; 3-Amino-2-[(3-Hydroxy-4-Oxo-1-Cyclohexa-2,5-Dienylidene)Methyl]-3-Mercaptoprop-2-Enenitrile; 3-Amino-2-[(3-Hydroxy-4-Keto-1-Cyclohexa-2,5-Dienylidene)Methyl]-3-Mercapto-Acrylonitrile
• Molecular Formula: C₁₀H₈N₂O₂S
• Molecular Weight: 220.25
• CAS Registry Number: 122520-86-9
• SMILES: O=C1C(=C\C(C=C1)=C\C(=C(S)\N)C#N)O
• InChI: 1S/C10H8N2O2S/c11-5-7(10(12)15)3-6-1-2-8(13)9(14)4-6/h1-4,14-15H,12H2/b6-3+,10-7+
• InChIKey: CTSHLCWTPAQAAB-HCUSPQTFSA-N