| Stereochemistry | ABSOLUTE |
| Molecular Formula | C20H25ClN6O2S |
| Molecular Weight | 448.97 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OCC1(CCC1)NC2=C3[S@@+]([O-])CCC3=NC(=N2)N4CCC(CC4)C5=NC=C(Cl)C=N5
InChI
InChIKey=UHYCLWAANUGUMN-PMERELPUSA-N
InChI=1S/C20H25ClN6O2S/c21-14-10-22-17(23-11-14)13-2-7-27(8-3-13)19-24-15-4-9-30(29)16(15)18(25-19)26-20(12-28)5-1-6-20/h10-11,13,28H,1-9,12H2,(H,24,25,26)/t30-/m0/s1
| Molecular Formula | C20H25ClN6O2S |
| Molecular Weight | 448.97 |
| 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 |