3-Acetyl-N-[3-(2-Amino-2-Oxoethyl)-5-Nitro-1,3-Thiazol-2-Ylidene]-2-Methylbenzamide
[CAS# 79798-91-7]

Identification

• Name: 3-Acetyl-N-[3-(2-Amino-2-Oxoethyl)-5-Nitro-1,3-Thiazol-2-Ylidene]-2-Methylbenzamide
• Synonyms: 3-Acetyl-N-[3-(2-Amino-2-Oxo-Ethyl)-5-Nitro-Thiazol-2-Ylidene]-2-Methyl-Benzamide; 3-Acetyl-N-[3-(2-Amino-2-Oxoethyl)-5-Nitro-2-Thiazolylidene]-2-Methylbenzamide; 3-Acetyl-N-[3-(2-Amino-2-Keto-Ethyl)-5-Nitro-Thiazol-2-Ylidene]-2-Methyl-Benzamide
• Molecular Formula: C₁₅H₁₄N₄O₅S
• Molecular Weight: 362.36
• CAS Registry Number: 79798-91-7
• SMILES: C2=C(C(=O)N=C1SC(=CN1CC(=O)N)[N+]([O-])=O)C(=C(C=C2)C(=O)C)C
• InChI: 1S/C15H14N4O5S/c1-8-10(9(2)20)4-3-5-11(8)14(22)17-15-18(6-12(16)21)7-13(25-15)19(23)24/h3-5,7H,6H2,1-2H3,(H2,16,21)
• InChIKey: PFDYTPRSMMYDGC-UHFFFAOYSA-N

Properties

• Density: 1.514g/cm³ (Cal.)
• Boiling point: 621.595°C at 760 mmHg (Cal.)
• Flash point: 329.729°C (Cal.)