Sodium 7-[2-[[(Benzylamino)Thioxomethyl]Amino]Ethyl]-1-Phenyl-3,8-Dithioxo-9-Thia-2,4,7-Triazadodecane-12-Sulphonate
[CAS# 2878-00-4]

Identification

• Name: Sodium 7-[2-[[(Benzylamino)Thioxomethyl]Amino]Ethyl]-1-Phenyl-3,8-Dithioxo-9-Thia-2,4,7-Triazadodecane-12-Sulphonate
• Synonyms: Sodium 3-[[[Bis[2-[[(Phenylmethylamino)-Thioxomethyl]Amino]Ethyl]Amino]-Thioxomethyl]Thio]Propane-1-Sulfonate; Sodium 3-[Bis[2-(Benzylthiocarbamoylamino)Ethyl]Thiocarbamoylthio]Propane-1-Sulfonate; 9-Thia-2,4,7-Triazadodecane-12-Sulfonic Acid, 1-Phenyl-7-(2-((((Phenylmethyl)Amino)Thioxomethyl)Amino)Ethyl)-3,8-Dithioxo-, Monosodium Salt
• Molecular Formula: C₂₄H₃₂N₅NaO₃S₅
• Molecular Weight: 621.84
• CAS Registry Number: 2878-00-4
• EINECS: 220-723-7
• SMILES: C2=C(CNC(=S)NCCN(C(SCCC[S]([O-])(=O)=O)=S)CCNC(=S)NCC1=CC=CC=C1)C=CC=C2.[Na+]
• InChI: 1S/C24H33N5O3S5.Na/c30-37(31,32)17-7-16-36-24(35)29(14-12-25-22(33)27-18-20-8-3-1-4-9-20)15-13-26-23(34)28-19-21-10-5-2-6-11-21;/h1-6,8-11H,7,12-19H2,(H2,25,27,33)(H2,26,28,34)(H,30,31,32);/q;+1/p-1
• InChIKey: CIGRFAIRUWLADG-UHFFFAOYSA-M