SPI 112
[CAS# 1051387-90-6]

Identification

• Name: SPI 112
• Molecular Formula: C₂₂H₁₇FN₄O₅S
• Molecular Weight: 468.46
• CAS Registry Number: 1051387-90-6
• SMILES: C1=CC(=CC(=C1)NNC2=C3C=C(C=CC3=NC2=O)S(=O)(=O)NCC4=CC=C(C=C4)F)C(=O)O
• InChI: 1S/C22H17FN4O5S/c23-15-6-4-13(5-7-15)12-24-33(31,32)17-8-9-19-18(11-17)20(21(28)25-19)27-26-16-3-1-2-14(10-16)22(29)30/h1-11,24,26H,12H2,(H,29,30)(H,25,27,28)
• InChIKey: ABVSYWGFUNXYAC-UHFFFAOYSA-N