Catalog Number:
AG009CDK
Chemical Name:
Mps1-in-2
CAS Number:
1228817-38-6
Molecular Formula:
C26H36N6O3
Molecular Weight:
480.6024
MDL Number:
MFCD28167735
IUPAC Name:
9-cyclopentyl-2-[2-ethoxy-4-(4-hydroxypiperidin-1-yl)anilino]-5-methyl-7,8-dihydropyrimido[4,5-b][1,4]diazepin-6-one
InChI:
InChI=1S/C26H36N6O3/c1-3-35-23-16-19(31-13-10-20(33)11-14-31)8-9-21(23)28-26-27-17-22-25(29-26)32(18-6-4-5-7-18)15-12-24(34)30(22)2/h8-9,16-18,20,33H,3-7,10-15H2,1-2H3,(H,27,28,29)
InChI Key:
WELBJLUKWAJOQV-UHFFFAOYSA-N
SMILES:
CCOc1cc(ccc1Nc1ncc2c(n1)N(CCC(=O)N2C)C1CCCC1)N1CCC(CC1)O
