Tivanidazole
[CAS# 80680-05-3]

Identification

• Name: Tivanidazole
• Synonyms: 2-Ethyl-5-[(E)-1-Methyl-2-(1-Methyl-5-Nitro-Imidazol-2-Yl)Vinyl]-1,3,4-Thiadiazole; 2-Ethyl-5-[(E)-1-Methyl-2-(1-Methyl-5-Nitro-2-Imidazolyl)Vinyl]-1,3,4-Thiadiazole; 2-Ethyl-5-[(E)-1-(1-Methyl-5-Nitro-Imidazol-2-Yl)Prop-1-En-2-Yl]-1,3,4-Thiadiazole
• Molecular Formula: C₁₁H₁₃N₅O₂S
• Molecular Weight: 279.32
• CAS Registry Number: 80680-05-3
• SMILES: C1=C([N](C(=N1)\C=C(C2=NN=C(S2)CC)/C)C)[N+](=O)[O-]
• InChI: 1S/C11H13N5O2S/c1-4-9-13-14-11(19-9)7(2)5-8-12-6-10(15(8)3)16(17)18/h5-6H,4H2,1-3H3/b7-5+
• InChIKey: FAMHRHPGWNQVGW-FNORWQNLSA-N

Properties

• Density: 1.433g/cm³ (Cal.)
• Boiling point: 487.094°C at 760 mmHg (Cal.)
• Flash point: 248.386°C (Cal.)