| Stereochemistry | ACHIRAL |
| Molecular Formula | C33H31FN6O3.2CH4O3S |
| Molecular Weight | 770.847 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CS(O)(=O)=O.CS(O)(=O)=O.NC1=NC2=C(C=C(N2)C3=CCN(CC3)C4COC4)C(=N1)C5=CC=CC(N6C=CC7=C(C6=O)C(F)=CC(=C7)C8CC8)=C5CO
InChI
InChIKey=KMLXYMRUQMJKLA-UHFFFAOYSA-N
InChI=1S/C33H31FN6O3.2CH4O3S/c34-26-13-21(18-4-5-18)12-20-8-11-40(32(42)29(20)26)28-3-1-2-23(25(28)15-41)30-24-14-27(36-31(24)38-33(35)37-30)19-6-9-39(10-7-19)22-16-43-17-22;2*1-5(2,3)4/h1-3,6,8,11-14,18,22,41H,4-5,7,9-10,15-17H2,(H3,35,36,37,38);2*1H3,(H,2,3,4)
| Molecular Formula | C33H31FN6O3 |
| Molecular Weight | 578.636 |
| Charge | 0 |
| Count |
MOL RATIO
1 MOL RATIO (average) |
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | CH4O3S |
| Molecular Weight | 96.106 |
| Charge | 0 |
| Count |
MOL RATIO
2 MOL RATIO (average) |
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
