| Stereochemistry | ACHIRAL |
| Molecular Formula | C17H15N7.2CH4O3S |
| Molecular Weight | 509.559 |
| 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.C1CC1NC2=NC(NC3=CC=C4N=CC=CC4=C3)=NC5=C2N=CN5
InChI
InChIKey=XWHARLVGMNPKNZ-UHFFFAOYSA-N
InChI=1S/C17H15N7.2CH4O3S/c1-2-10-8-12(5-6-13(10)18-7-1)22-17-23-15-14(19-9-20-15)16(24-17)21-11-3-4-11;2*1-5(2,3)4/h1-2,5-9,11H,3-4H2,(H3,19,20,21,22,23,24);2*1H3,(H,2,3,4)
| Molecular Formula | C17H15N7 |
| Molecular Weight | 317.3479 |
| 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 |
