Stereochemistry | UNKNOWN |
Molecular Formula | C17H18N6O |
Molecular Weight | 322.3644 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 2 / 3 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OC1CC[C@@H](C1)[C@@H](CC#N)N2C=C(C=N2)C3=NC=NC4=C3C=CN4
InChI
InChIKey=PEDGDCYQFZPRCX-ABIUDSBCSA-N
InChI=1S/C17H18N6O/c18-5-3-15(11-1-2-13(24)7-11)23-9-12(8-22-23)16-14-4-6-19-17(14)21-10-20-16/h4,6,8-11,13,15,24H,1-3,7H2,(H,19,20,21)/t11?,13?,15-/m1/s1
Molecular Formula | C17H18N6O |
Molecular Weight | 322.3644 |
Charge | 0 |
Count |
MOL RATIO
1 MOL RATIO (average) |
Stereochemistry | EPIMERIC |
Additional Stereochemistry | No |
Defined Stereocenters | 2 / 3 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |