3,3'-Dithiobis[N-methyl-N-[2-[methyl[(2,5,9-trimethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-3-yl)methyl]amino]ethyl]propanamide]
[CAS# 112250-61-0]

Identification

• Name: 3,3'-Dithiobis[N-methyl-N-[2-[methyl[(2,5,9-trimethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-3-yl)methyl]amino]ethyl]propanamide]
• Synonyms: N-Methyl-3-[3-[Methyl-[2-[Methyl-[(2,5,9-Trimethyl-7-Oxo-Furo[4,5-G]Chromen-3-Yl)Methyl]Amino]Ethyl]Amino]-3-Oxo-Propyl]Disulfanyl-N-[2-[Methyl-[(2,5,9-Trimethyl-7-Oxo-Furo[4,5-G]Chromen-3-Yl)Methyl]Amino]Ethyl]Propanamide; N-Methyl-3-[3-[Methyl-[2-[Methyl-[(2,5,9-Trimethyl-7-Oxo-3-Furo[4,5-G]Chromenyl)Methyl]Amino]Ethyl]Amino]-3-Oxopropyl]Disulfanyl-N-[2-[Methyl-[(2,5,9-Trimethyl-7-Oxo-3-Furo[4,5-G]Chromenyl)Methyl]Amino]Ethyl]Propanamide; 3-[3-Keto-3-[2-[(7-Keto-2,5,9-Trimethyl-Furo[4,5-G]Chromen-3-Yl)Methyl-Methyl-Amino]Ethyl-Methyl-Amino]Propyl]Disulfanyl-N-[2-[(7-Keto-2,5,9-Trimethyl-Furo[4,5-G]Chromen-3-Yl)Methyl-Methyl-Amino]Ethyl]-N-Methyl-Propionamide
• Molecular Formula: C₄₄H₅₄N₄O₈S₂
• Molecular Weight: 831.05
• CAS Registry Number: 112250-61-0
• SMILES: C1=C6C(=C(C2=C1C(=C(O2)C)CN(CCN(C(=O)CCSSCCC(=O)N(CCN(CC3=C(OC4=C3C=C5C(=C4C)OC(=O)C=C5C)C)C)C)C)C)C)OC(=O)C=C6C
• InChI: 1S/C44H54N4O8S2/c1-25-19-39(51)55-41-27(3)43-33(21-31(25)41)35(29(5)53-43)23-45(7)13-15-47(9)37(49)11-17-57-58-18-12-38(50)48(10)16-14-46(8)24-36-30(6)54-44-28(4)42-32(22-34(36)44)26(2)20-40(52)56-42/h19-22H,11-18,23-24H2,1-10H3
• InChIKey: IOTZAFHOGRWAKS-UHFFFAOYSA-N

Properties

• Density: 1.268g/cm³ (Cal.)
• Boiling point: 931.581°C at 760 mmHg (Cal.)
• Flash point: 517.202°C (Cal.)