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Details

Stereochemistry ACHIRAL
Molecular Formula C18H22N8O2S
Molecular Weight 414.485
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0
Stereo Comments Meso

SHOW SMILES / InChI
Structure of IVARMACITINIB

SMILES

COC1=NSC(NC(=O)N2C[C@@H]3C[C@H](C[C@@H]3C2)N(C)C4=NC=NC5=C4C=CN5)=N1

InChI

InChIKey=DNBCBAXDWNDRNO-GDNZZTSVSA-N
InChI=1S/C18H22N8O2S/c1-25(15-13-3-4-19-14(13)20-9-21-15)12-5-10-7-26(8-11(10)6-12)18(27)23-17-22-16(28-2)24-29-17/h3-4,9-12H,5-8H2,1-2H3,(H,19,20,21)(H,22,23,24,27)/t10-,11+,12+

HIDE SMILES / InChI

Approval Year