4-Methyl-N-(4-((4-Nitrophenyl)Amino)Phenyl)-1-Piperazinecarbothioamide 4-Oxide
[CAS# 113962-61-1]

Identification

• Name: 4-Methyl-N-(4-((4-Nitrophenyl)Amino)Phenyl)-1-Piperazinecarbothioamide 4-Oxide
• Synonyms: 4-Methyl-N-[4-[(4-Nitrophenyl)Amino]Phenyl]-4-Oxido-Piperazin-4-Ium-1-Carbothioamide; 4-Methyl-N-[4-[(4-Nitrophenyl)Amino]Phenyl]-4-Oxido-1-Piperazin-4-Iumcarbothioamide; 1-Piperazinecarbothioamide, 4-Methyl-N-(4-((4-Nitrophenyl)Amino)Phenyl)-, 4-Oxide
• Molecular Formula: C₁₈H₂₁N₅O₃S
• Molecular Weight: 387.46
• CAS Registry Number: 113962-61-1
• SMILES: C2=C(NC(=S)N1CC[N+]([O-])(CC1)C)C=CC(=C2)NC3=CC=C([N+]([O-])=O)C=C3
• InChI: 1S/C18H21N5O3S/c1-23(26)12-10-21(11-13-23)18(27)20-16-4-2-14(3-5-16)19-15-6-8-17(9-7-15)22(24)25/h2-9,19H,10-13H2,1H3,(H,20,27)
• InChIKey: JSGITMPYGNUQPT-UHFFFAOYSA-N