N,N'-[[6-(Methylthio)-1,3,5-Triazine-2,4-Diyl]Bis[Imino(9,10-Dihydro-9,10-Dioxoanthracene-5,1-Diyl)]]Bis(Benzamide)
[CAS# 71459-28-4]

Identification

• Name: N,N'-[[6-(Methylthio)-1,3,5-Triazine-2,4-Diyl]Bis[Imino(9,10-Dihydro-9,10-Dioxoanthracene-5,1-Diyl)]]Bis(Benzamide)
• Synonyms: N-[5-[[4-[[5-(Benzoylamino)-9,10-Dioxo-1-Anthryl]Amino]-6-Methylsulfanyl-1,3,5-Triazin-2-Yl]Amino]-9,10-Dioxo-1-Anthryl]Benzamide; N-[5-[[4-[[9,10-Dioxo-5-[(Oxo-Phenylmethyl)Amino]-1-Anthryl]Amino]-6-(Methylthio)-1,3,5-Triazin-2-Yl]Amino]-9,10-Dioxo-1-Anthryl]Benzamide; N-[5-[[4-[[5-(Benzoylamino)-9,10-Diketo-1-Anthryl]Amino]-6-(Methylthio)-S-Triazin-2-Yl]Amino]-9,10-Diketo-1-Anthryl]Benzamide
• Molecular Formula: C₄₆H₂₉N₇O₆S
• Molecular Weight: 807.84
• CAS Registry Number: 71459-28-4
• EINECS: 275-462-1
• SMILES: C6=CC=C(NC1=NC(=NC(=N1)SC)NC2=CC=CC3=C2C(=O)C4=C(C3=O)C(=CC=C4)NC(=O)C5=CC=CC=C5)C7=C6C(=O)C8=C(C7=O)C=CC=C8NC(=O)C9=CC=CC=C9
• InChI: 1S/C46H29N7O6S/c1-60-46-52-44(49-32-22-10-18-28-36(32)40(56)26-16-8-20-30(34(26)38(28)54)47-42(58)24-12-4-2-5-13-24)51-45(53-46)50-33-23-11-19-29-37(33)41(57)27-17-9-21-31(35(27)39(29)55)48-43(59)25-14-6-3-7-15-25/h2-23H,1H3,(H,47,58)(H,48,59)(H2,49,50,51,52,53)
• InChIKey: PCSLQKFKSMBVDF-UHFFFAOYSA-N

Properties

• Density: 1.563g/cm³ (Cal.)