Catalog Number:
AG009CDM
Chemical Name:
Mutant IDH1 inhibitor
CAS Number:
1429180-08-4
Molecular Formula:
C25H34N6O3
Molecular Weight:
466.5759
MDL Number:
MFCD28167739
IUPAC Name:
(4S)-3-[2-[[(1S)-1-[4-[(4-acetylpiperazin-1-yl)methyl]phenyl]ethyl]amino]pyrimidin-4-yl]-4-propan-2-yl-1,3-oxazolidin-2-one
InChI:
InChI=1S/C25H34N6O3/c1-17(2)22-16-34-25(33)31(22)23-9-10-26-24(28-23)27-18(3)21-7-5-20(6-8-21)15-29-11-13-30(14-12-29)19(4)32/h5-10,17-18,22H,11-16H2,1-4H3,(H,26,27,28)/t18-,22+/m0/s1
InChI Key:
BEWLUEOYYPKPQL-PGRDOPGGSA-N
SMILES:
CC([C@H]1COC(=O)N1c1ccnc(n1)N[C@H](c1ccc(cc1)CN1CCN(CC1)C(=O)C)C)C
