[(Z)-[(E)-4-Thiophen-2-Ylbut-3-En-2-Ylidene]Thiocarbamoyl]Thiourea
[CAS# 6622-81-7]

Identification

• Name: [(Z)-[(E)-4-Thiophen-2-Ylbut-3-En-2-Ylidene]Thiocarbamoyl]Thiourea
• Synonyms: 3-Carbamothioyl-1-(4-Thiophen-2-Ylbut-3-En-2-Ylidene)Thiourea; 3-Carbamothioyl-1-[1-Methyl-3-(2-Thienyl)Prop-2-Enylidene]Thiourea; (1E)-3-Carbamothioyl-1-[(E)-1-Methyl-3-(2-Thienyl)Prop-2-Enylidene]Thiourea
• Molecular Formula: C₁₀H₁₁N₃S₃
• Molecular Weight: 269.40
• CAS Registry Number: 6622-81-7
• SMILES: C1=C(SC=C1)\C=C\C(=NC(=S)NC(N)=S)C
• InChI: 1S/C10H11N3S3/c1-7(12-10(15)13-9(11)14)4-5-8-3-2-6-16-8/h2-6H,1H3,(H3,11,13,14,15)/b5-4+,12-7?
• InChIKey: YXIOUDLMRQPQGZ-LECZDAOFSA-N

Properties

• Density: 1.332g/cm³ (Cal.)
• Boiling point: 426.767°C at 760 mmHg (Cal.)
• Flash point: 211.901°C (Cal.)