Catalog Number:
AG008TIB
Chemical Name:
MLN4924 hydrochloride
CAS Number:
1160295-21-5
Molecular Formula:
C21H26ClN5O4S
Molecular Weight:
479.9802
MDL Number:
MFCD17215670
IUPAC Name:
[(1S,2S,4R)-4-[4-[[(1S)-2,3-dihydro-1H-inden-1-yl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]-2-hydroxycyclopentyl]methyl sulfamate;hydrochloride
InChI:
InChI=1S/C21H25N5O4S.ClH/c22-31(28,29)30-11-14-9-15(10-19(14)27)26-8-7-17-20(23-12-24-21(17)26)25-18-6-5-13-3-1-2-4-16(13)18;/h1-4,7-8,12,14-15,18-19,27H,5-6,9-11H2,(H2,22,28,29)(H,23,24,25);1H/t14-,15+,18-,19-;/m0./s1
InChI Key:
HJKDNNXKYODZJI-BVMPOVDASA-N
SMILES:
O[C@H]1C[C@@H](C[C@H]1COS(=O)(=O)N)n1ccc2c1ncnc2N[C@H]1CCc2c1cccc2.Cl
UNII:
28I8PCX76B
