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Details

Stereochemistry ACHIRAL
Molecular Formula C15H15N7O.2CH4O3S
Molecular Weight 501.537
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SAPANISERTIB DIMESYLATE

SMILES

CS(O)(=O)=O.CS(O)(=O)=O.CC(C)N1N=C(C2=C(N)N=CN=C12)C3=CC=C4OC(N)=NC4=C3

InChI

InChIKey=RIAVGZKNRXZPEG-UHFFFAOYSA-N
InChI=1S/C15H15N7O.2CH4O3S/c1-7(2)22-14-11(13(16)18-6-19-14)12(21-22)8-3-4-10-9(5-8)20-15(17)23-10;2*1-5(2,3)4/h3-7H,1-2H3,(H2,17,20)(H2,16,18,19);2*1H3,(H,2,3,4)

HIDE SMILES / InChI

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

Molecular Formula C15H15N7O
Molecular Weight 309.3259
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

Approval Year

Substance Class Chemical
Record UNII
SB2601C5MF
Record Status Validated (UNII)
Record Version