Donetidine
[CAS# 99248-32-5]

Identification

• Name: Donetidine
• Synonyms: 2-[2-[[5-(Dimethylaminomethyl)-2-Furyl]Methylsulfanyl]Ethylamino]-5-[(2-Oxo-1H-Pyridin-3-Yl)Methyl]-3H-Pyrimidin-4-One; 2-[2-[[5-(Dimethylaminomethyl)-2-Furyl]Methylthio]Ethylamino]-5-[(2-Oxo-1H-Pyridin-3-Yl)Methyl]-3H-Pyrimidin-4-One; 2-[2-[[5-(Dimethylami
• Molecular Formula: C₂₀H₂₅N₅O₃S
• Molecular Weight: 415.51
• CAS Registry Number: 99248-32-5
• SMILES: C1=C(OC(=C1)CSCCNC3=NC=C(CC2=CC=CNC2=O)C(=O)N3)CN(C)C
• InChI: 1S/C20H25N5O3S/c1-25(2)12-16-5-6-17(28-16)13-29-9-8-22-20-23-11-15(19(27)24-20)10-14-4-3-7-21-18(14)26/h3-7,11H,8-10,12-13H2,1-2H3,(H,21,26)(H2,22,23,24,27)
• InChIKey: ZZHPEHZVLGBGAK-UHFFFAOYSA-N

Properties

• Density: 1.33g/cm³ (Cal.)