5-[(Morpholin-4-Ylamino)Methyl]-1-[(2-Oxo-2-Phenothiazin-10-Ylethyl)Amino]-3-Phenyl-2-Sulfanylidene-1,3-Diazinane-4,6-Dione
[CAS# 141177-53-9]

Identification

• Name: 5-[(Morpholin-4-Ylamino)Methyl]-1-[(2-Oxo-2-Phenothiazin-10-Ylethyl)Amino]-3-Phenyl-2-Sulfanylidene-1,3-Diazinane-4,6-Dione
• Synonyms: 5-[(Morpholinoamino)Methyl]-1-[(2-Oxo-2-Phenothiazin-10-Yl-Ethyl)Amino]-3-Phenyl-2-Thioxo-Hexahydropyrimidine-4,6-Dione; 5-[(Morpholinoamino)Methyl]-1-[[2-Oxo-2-(10-Phenothiazinyl)Ethyl]Amino]-3-Phenyl-2-Thioxohexahydropyrimidine-4,6-Dione; 1-[(2-Keto-2-Phenothiazin-10-Yl-Ethyl)Amino]-5-[(Morpholinoamino)Methyl]-3-Phenyl-2-Thioxo-Hexahydropyrimidine-4,6-Quinone
• Molecular Formula: C₂₉H₂₈N₆O₄S₂
• Molecular Weight: 588.70
• CAS Registry Number: 141177-53-9
• SMILES: C1=CC=CC2=C1N(C3=C(S2)C=CC=C3)C(=O)CNN4C(N(C(C(C4=O)CNN5CCOCC5)=O)C6=CC=CC=C6)=S
• InChI: 1S/C29H28N6O4S2/c36-26(34-22-10-4-6-12-24(22)41-25-13-7-5-11-23(25)34)19-31-35-28(38)21(18-30-32-14-16-39-17-15-32)27(37)33(29(35)40)20-8-2-1-3-9-20/h1-13,21,30-31H,14-19H2
• InChIKey: IYQCAIPEFAHVIH-UHFFFAOYSA-N

Properties

• Density: 1.521g/cm³ (Cal.)
• Boiling point: 792.533°C at 760 mmHg (Cal.)
• Flash point: 433.108°C (Cal.)