Sodium 3-[[[(1,5-Dihydro-3-Heptadecyl-5-Thioxo-4H-1,2,4-Triazol-4-Yl)Amino]Carbonyl]Amino]Benzenesulphonate
[CAS# 23455-89-2]

Identification

• Name: Sodium 3-[[[(1,5-Dihydro-3-Heptadecyl-5-Thioxo-4H-1,2,4-Triazol-4-Yl)Amino]Carbonyl]Amino]Benzenesulphonate
• Synonyms: Sodium 3-[(3-Heptadecyl-5-Thioxo-1H-1,2,4-Triazol-4-Yl)Carbamoylamino]Benzenesulfonate; Sodium 3-[[[(3-Heptadecyl-5-Thioxo-1H-1,2,4-Triazol-4-Yl)Amino]-Oxomethyl]Amino]Benzenesulfonate; Benzenesulfonic Acid, 3-((((3-Heptadecyl-1,5-Dihydro-5-Thioxo-4H-1,2,4-Triazol-4-Yl)Amino)Carbonyl)Amino)-, Monosodium Salt
• Molecular Formula: C₂₆H₄₂N₅NaO₄S₂
• Molecular Weight: 575.76
• CAS Registry Number: 23455-89-2
• EINECS: 245-671-2
• SMILES: C1=C([S]([O-])(=O)=O)C=CC=C1NC(=O)NN2C(=NNC2=S)CCCCCCCCCCCCCCCCC.[Na+]
• InChI: 1S/C26H43N5O4S2.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-24-28-29-26(36)31(24)30-25(32)27-22-18-17-19-23(21-22)37(33,34)35;/h17-19,21H,2-16,20H2,1H3,(H,29,36)(H2,27,30,32)(H,33,34,35);/q;+1/p-1
• InChIKey: CPOQUTNRVYYLIM-UHFFFAOYSA-M